58620-93-2 (B-丙胺酸书叔丁基醚盐酸盐,H-β-Ala-OtBu.HCl)

快速询单

结构式：

B-丙胺酸书叔丁基醚盐酸盐MOL文件

CAS号：

58620-93-2

中文名称：

B-丙胺酸书叔丁基醚盐酸盐

英文名称：

H-β-Ala-OtBu.HCl

分子式：

C₇H₁₆ClNO₂

分子量：

181.660441398621

简介：

H-β-Ala-OtBu.HCl 是一种丙氨酸衍生物。

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)名称与标识符

名称

中文别名：

Β-丙氨酸叔丁酯盐酸盐;beta-Alanine tert-Butyl Ester Hydrochloride β-丙氨酸叔丁酯盐酸盐;BETA-丙氨酸叔丁酯盐酸盐;b-丙氨酸叔丁酯盐酸盐;B-丙胺酸书叔丁基醚盐酸盐;

英文别名：

tert-Butyl 3-aminopropanoate hydrochloride;H-β-Ala-OtBu.HCl;beta-Alanine tert-Butyl Ester Hydrochloride;β-Alanine t-butyl ester hydrochloride;B-Alanine T-Butyl Ester Hydrochloride;b-Alanine, 1,1-dimethylethylester, hydrochloride (1:1);H-b-Ala-OtBu.HCl;H-BETA-ALA-OTBU HCL;H-beta-Ala-OtBu·HCl;H-β-Alanine tert·butyl ester hydrochloride;H-β-Ala-OtBu · HCl;H-β-Ala-OtBu•HCl;β-Alanine tert-butyl ester hydrochloride;H-β-Ala-OtBu·HCl;H-beta-Ala-OtBu.HCl;H-;A-Ala-OtBu.HCl;beta-Alanine t-butyl ester hydrochloride;3-amino-propionic acid tert-butyl ester hydrochloride;H-?-Ala-OtBu.HCl;H-Beta-Ala-OtBu hydrochloride;tert-butyl 3-aminopropanoate-HCl;DOMTZTVJNZKUNX-UHFFFAOYSA-N;be;H-?-Alaninetert inverted exclamation mark currencybutylesterhydrochloride;SY020711;FT-0647779;3-Aminopropionic acid tert-butyl ester hydrochloride;DTXSID30585057;A831953;tert.-butyl beta-alaninate hydrochloride;beta-alanine 1,1-dimethylethyl ester hydrochloride;beta-alanine tert-butylester hydrochloride;J-300314;A-Alanine tert inverted exclamation mark currencybutyl ester hydrochloride;58620-93-2;CS-W007578;GS-4172;AKOS015847722;TERT-BUTYL 3-AMINOPROPANOATE HCL;I(2)-Alanine t-butyl ester hydrochloride;ss-Alanine t-butyl ester hydrochloride;tert-Butyl beta-alaninate--hydrogen chloride (1/1);MFCD00058258;beta-alanine t-butyl ester HCl salt;H-beta-Alanine tert.butyl ester hydrochloride;tert-butyl 3-aminopropanoate;hydrochloride;beta-Alanine tert-butyl ester hydrochloride;tert-butyl 3-aminopropanoate hydrochloride;H-beta-Ala-OtBu.HCl;SCHEMBL535279;A-Alanine t-butyl ester hydrochloride;tert-butyl beta-alaninate hydrochloride;b-Alanine Tert-butyl Ester Hydrochloride;tert-butyl 3-aminopropionate hydrochloride;EN300-128251;AM20100429;HY-W007578;A2772;H-b-Alanine tert-butyl ester hydrochloride;DB-072507;

标识符

MDL：

MFCD00058258

InChIKey：

DOMTZTVJNZKUNX-UHFFFAOYSA-N

Inchi：

1S/C7H15NO2.ClH/c1-7(2,3)10-6(9)4-5-8;/h4-5,8H2,1-3H3;1H

SMILES：

Cl.O(C(CCN)=O)C(C)(C)C

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)物化性质

实验特性

LogP : 2.17920
PSA : 52.32000
沸点 : No data available
熔点 : 167-169℃
蒸气压 : No data available
闪点 : No data available
溶解度 : Clear solution (0.3g in 2ml MeOH).
颜色与性状 : 未确定

计算特性

精确分子量 : 181.08700
氢键供体数量 : 2
氢键受体数量 : 3
可旋转化学键数量 : 4
同位素质量 : 181.0869564g/mol
重原子数量 : 11
复杂度 : 115
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 2
疏水参数计算参考值（XlogP） : 无
互变异构体数量 : 无
表面电荷 : 0
拓扑分子极性表面积 : 52.3

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)安全信息

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)国际标准相关数据

EINECS：

24890719

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)生产方法和用途

用途：

化学试剂

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)推荐厂家更多厂家(57)

公司名称	手机号/电话	联系人	QQ	询单
江苏吉泰肽业科技有限公司	18762539991 0515-80855088	孙亭凤	435898806	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
湖北方德新材料有限公司	18086096695	邱经理	1462312301	询单
江苏吉泰肽业科技有限公司	18762539991 0515-80855088	孙亭凤	435898806	询单
西安德而塔生物科技有限公司	18133906270 18133906270	张女士	2590956145	询单
JACS-郑州杰克斯化工产品有限公司	13223061139 0371-86259281	杰克斯JACS	893596907	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
上海创赛科技有限公司	15021221957 021-59553580	凌度	2852351983	询单
上海腾准生物科技有限公司	19821570922 021-34053661	张经理	3003871136	询单
湖北垚烁泉化工有限公司	18971203904	黄经理	1601302530	询单

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2)参考资料

Reaxys RN：

6660122

Beilstein：

MFCD00058258

PubChem CID：

16218890

B-丙胺酸书叔丁基醚盐酸盐(58620-93-2) MSDS

基础信息

Section 1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE
  Product identifiers
    : β-Alanine t-butyl ester hydrochloride
    Product name
    CAS-No.        : 58620-93-2
  Relevant identified uses of the substance or mixture and uses advised against
    Identified uses        : Laboratory chemicals, Manufacture of substances

Section 2. HAZARDS IDENTIFICATION
  Classification of the substance or mixture
    Not a hazardous substance or mixture according to Regulation (EC) No 1272/2008
    This substance is not classified as dangerous according to Directive 67/548/EEC.
  Label elements
    Caution - substance not yet tested completely.
  Other hazards - none

Section 3. COMPOSITION/INFORMATION ON INGREDIENTS
  Substances
    Formula        : C7H15NO2 · HCl
    Molecular Weight        : 181,66 g/mol

Section 4. FIRST AID MEASURES
  Description of first aid measures
  If inhaled
    If breathed in, move person into fresh air. If not breathing, give artificial respiration.
  In case of skin contact
    Wash off with soap and plenty of water.
  In case of eye contact
    Flush eyes with water as a precaution.
  If swallowed
    Never give anything by mouth to an unconscious person. Rinse mouth with water.
  Most important symptoms and effects, both acute and delayed
  Indication of any immediate medical attention and special treatment needed
    no data available

Section 5. FIREFIGHTING MEASURES
  Extinguishing media
  Suitable extinguishing media
    Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
  Special hazards arising from the substance or mixture
    Carbon oxides, nitrogen oxides (NOx), Hydrogen chloride gas
  Advice for firefighters
    Wear self contained breathing apparatus for fire fighting if necessary.
  Further information
    no data available

Section 6. ACCIDENTAL RELEASE MEASURES
  Personal precautions, protective equipment and emergency procedures
    Avoid dust formation. Avoid breathing vapors, mist or gas.
  Environmental precautions
    Do not let product enter drains.
  Methods and materials for containment and cleaning up
    Sweep up and shovel. Keep in suitable, closed containers for disposal.
  Reference to other sections
    For disposal see section 13.

Section 7. HANDLING AND STORAGE
  Precautions for safe handling
    Provide appropriate exhaust ventilation at places where dust is formed.Normal measures for preventive fire
    protection.
  Conditions for safe storage, including any incompatibilities
    Store in cool place. Keep container tightly closed in a dry and well-ventilated place.
    Recommended storage temperature: -20 °C
  Specific end uses
    no data available

Section 8. EXPOSURE CONTROLS/PERSONAL PROTECTION
  Control parameters
  Components with workplace control parameters
  Exposure controls
  Appropriate engineering controls
    General industrial hygiene practice.
  Personal protective equipment
  Eye/face protection
    Use equipment for eye protection tested and approved under appropriate government standards
    such as NIOSH (US) or EN 166(EU).
  Skin protection
    Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique
    (without touching glove's outer surface) to avoid skin contact with this product. Dispose of
    contaminated gloves after use in accordance with applicable laws and good laboratory practices.
    Wash and dry hands.
    The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and
    the standard EN 374 derived from it.
  Body Protection
    Choose body protection in relation to its type, to the concentration and amount of dangerous
    substances, and to the specific work-place., The type of protective equipment must be selected
    according to the concentration and amount of the dangerous substance at the specific workplace.
  Respiratory protection
    Respiratory protection is not required. Where protection from nuisance levels of dusts are desired,
    use type N95 (US) or type P1 (EN 143) dust masks. Use respirators and components tested and
    approved under appropriate government standards such as NIOSH (US) or CEN (EU).

Section 9. PHYSICAL AND CHEMICAL PROPERTIES
  Information on basic physical and chemical properties
    a) Appearance        Form: solid
    b) Odour        no data available
    c) Odour Threshold        no data available
    d) pH        no data available
    e) Melting point/freezing        no data available
    point
    f) Initial boiling point and no data available
    boiling range
    g) Flash point        no data available
    h) Evaporation rate        no data available
    i) Flammability (solid, gas) no data available
    j) Upper/lower        no data available
    flammability or
    explosive limits
    k) Vapour pressure        no data available
    l) Vapour density        no data available
    m) Relative density        no data available
    n) Water solubility        no data available
    o) Partition coefficient: n- no data available
    octanol/water
    p) Autoignition        no data available
    temperature
    q) Decomposition        no data available
    temperature
    r) Viscosity        no data available
    s) Explosive properties        no data available
    t) Oxidizing properties        no data available
  Other safety information
    no data available

Section 10. STABILITY AND REACTIVITY
  Reactivity
    no data available
  Chemical stability
    no data available
  Possibility of hazardous reactions
    no data available
  Conditions to avoid
    no data available
  Incompatible materials
    Strong oxidizing agents
  Hazardous decomposition products
    Other decomposition products - no data available

Section 11. TOXICOLOGICAL INFORMATION
  Information on toxicological effects
  Acute toxicity
    no data available
  Skin corrosion/irritation
    no data available
  Serious eye damage/eye irritation
    no data available
  Respiratory or skin sensitization
    no data available
  Germ cell mutagenicity
    no data available
  Carcinogenicity
    IARC:        No component of this product present at levels greater than or equal to 0.1% is identified as
    probable, possible or confirmed human carcinogen by IARC.
  Reproductive toxicity
    no data available
  Specific target organ toxicity - single exposure
    no data available
  Specific target organ toxicity - repeated exposure
    no data available
  Aspiration hazard
    no data available
  Potential health effects
  Inhalation
    May be harmful if inhaled. May cause respiratory tract irritation.
  Ingestion        May be harmful if swallowed.
  Skin        May be harmful if absorbed through skin. May cause skin irritation.
  Eyes        May cause eye irritation.
  Additional Information
    RTECS: Not available

Section 12. ECOLOGICAL INFORMATION
  Toxicity
    no data available
  Persistence and degradability
    no data available
  Bioaccumulative potential
    no data available
  Mobility in soil
    no data available
  Results of PBT and vPvB assessment
    no data available
  Other adverse effects
    no data available

Section 13. DISPOSAL CONSIDERATIONS
  Waste treatment methods
  Product
    Offer surplus and non-recyclable solutions to a licensed disposal company.
  Contaminated packaging
    Dispose of as unused product.

Section 14. TRANSPORT INFORMATION
  UN number
    ADR/RID: -        IMDG: -        IATA: -
  UN proper shipping name
    ADR/RID: Not dangerous goods
    IMDG: Not dangerous goods
    IATA:        Not dangerous goods
  Transport hazard class(es)
    ADR/RID: -        IMDG: -        IATA: -
  Packaging group
    ADR/RID: -        IMDG: -        IATA: -
  Environmental hazards
    ADR/RID: no        IMDG Marine pollutant: no        IATA: no
  Special precautions for user
    no data available

Section 15. REGULATORY INFORMATION
    This safety datasheet complies with the requirements of Regulation (EC) No. 1907/2006.
  Safety, health and environmental regulations/legislation specific for the substance or mixture
    no data available
  Chemical Safety Assessment
    no data available

Section 16. OTHER INFORMATION
  Further information
    Copyright 2012 Co. LLC. License granted to make unlimited paper copies for internal use
    only.
    The above information is believed to be correct but does not purport to be all inclusive and shall be
    used only as a guide. The information in this document is based on the present state of our knowledge
    and is applicable to the product with regard to appropriate safety precautions. It does not represent any
    guarantee of the properties of the product. Corporation and its Affiliates shall not be held
    liable for any damage resulting from handling or from contact with the above product. See
     and/or the reverse side of invoice or packing slip for additional terms and conditions of sale.