3096-70-6 (3,5-二甲基-4-氨基苯酚,4-Amino-3,5-xylenol)

快速询单

结构式：

3,5-二甲基-4-氨基苯酚MOL文件

CAS号：

3096-70-6

中文名称：

3,5-二甲基-4-氨基苯酚

英文名称：

4-Amino-3,5-xylenol

安全信息：

分子式：

C₈H₁₁NO

分子量：

137.179042100906

3,5-二甲基-4-氨基苯酚(3096-70-6)名称与标识符

名称

中文别名：

3,5-二甲基-4-氨基苯酚;4-氨基-3,5-二甲苯酚;4 - 甲氧基-3 - 硝基苯胺;4-Amino-3,5-xylenol 4-氨基-3,5-二甲苯酚;4-氨基-3,5-二甲酚;4-氨基-3,5-二甲基苯酚;3.5-二甲基-4-胺基苯酚;4-羟基-2,6-二甲基苯胺;

英文别名：

4-Amino-3,5-dimethylphenol;4-Amino-3,5-xylenol;3,5-DIMETHY-4-AMINOPHENOL;1,3-Dimethyl-2-amino-5-xylenol;2,6-dimethyl-4-hydroxyaniline;3,5-dimethyl-4-amino phenol;3,5-Xylenol,4-amino;4-Amino-3,5-dimethyl-phenol;4-Hydroxy-2,6-dimethylaniline;EINECS 221-448-5;4-13-00-01855 (Beilstein Handbook Reference);WLN: ZR DQ B1 F1;CHEBI:55545;GCWYXRHXGLFVFE-UHFFFAOYSA-N;1S8G005MHP;MFCD01741459;Phenol, 4-amino-3,5-dimethyl-;SCHEMBL282802;3096-70-6;4-Amino-3,5-dimethylphenol, AldrichCPR;EN300-136242;DTXSID8040272;UNII-1S8G005MHP;Q27124362;NS00029003;3,5-Dimethyl-4-aminophenol;AS-14517;NSC 38030;SY021250;3,5-Xylenol, 4-amino-;FT-0634663;BRN 2082260;CS-W019281;AKOS003389145;NSC-38030;3, 4-amino-;F20954;W-106922;NSC38030;Phenol, 4-amino-3,5-dimethyl-(9CI);A1860;DB-047939;STK664990;DTXCID6020272;ALBB-025304;4-Amino-3,5-dimethyl-phenol; 3,5-Dimethyl-4-aminophenol; 4-Hydroxy-2,6-dimethylaniline; 4-Hydroxy-2,6-xylidine; NSC 38030;;

标识符

MDL：

MFCD01741459

InChIKey：

GCWYXRHXGLFVFE-UHFFFAOYSA-N

Inchi：

1S/C8H11NO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,9H2,1-2H3

SMILES：

OC1C=C(C)C(=C(C)C=1)N

BRN：

13(4)1855

3,5-二甲基-4-氨基苯酚(3096-70-6)物化性质

实验特性

LogP : 2.17240
PSA : 46.25000
折射率 : 1.6
沸点 : 296.5℃ at 760 mmHg
熔点 : 180.0 to 186.0 deg-C
闪点 : 133.1°C
颜色与性状 : 无可用
溶解性 : 无可用
密度 : 1.118

计算特性

精确分子量 : 137.08400
氢键供体数量 : 2
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 137.084
重原子数量 : 10
复杂度 : 104
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 : 1
疏水参数计算参考值（XlogP） : 无
互变异构体数量 : 10
表面电荷 : 0
拓扑分子极性表面积 : 46.2A^2

3,5-二甲基-4-氨基苯酚(3096-70-6)安全信息

符号： GHS07
RTECS号： ZE6740000
安全说明： 61
危险品标志： N
危害声明：H302+H312+H332-H315-H319
警示性声明：P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
提示语：警告
储存条件： Store at room temperature
危险类别码： 50
信号词： Warning

3,5-二甲基-4-氨基苯酚(3096-70-6)国际标准相关数据

EINECS：

221-448-5

3,5-二甲基-4-氨基苯酚(3096-70-6)海关数据

海关编码：

2922299090

海关数据：

中国海关编码：

2922299090

概述：

2922299090. 其他氨基(萘酚、酚)及醚、酯〔包括它们的盐, 但含有一种以上含氧基的除外〕. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0%

申报要素：

品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装

Summary：

2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

3,5-二甲基-4-氨基苯酚(3096-70-6)生产方法和用途

用途：

用作医药中间体

3,5-二甲基-4-氨基苯酚(3096-70-6)推荐厂家更多厂家(40)

公司名称	手机号/电话	联系人	QQ	询单
湖北摆渡化学有限公司	18871490324 027-59106051	彭星	1400878899	询单
湖北万得化工有限公司	15827180502 027-59210159	陈丹丹	1148980033	询单
上海吉至生化科技有限公司	18117592386 021-57481218	吉至试剂	3007522982	询单
湖北方德新材料有限公司	18086096695	邱经理	1462312301	询单
西安德而塔生物科技有限公司	18133906270 18133906270	张女士	2590956145	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
湖北信康医药化工有限公司	13476235517 13476235517	杨彩云	1438280055	询单
巨胜化学研究院	18064118002 027-59599240	陈盼	1400838822	询单
湖北信康药化有限公司化学研究所	18827031272 027-59308705	张欢	1438980011	询单
湖北健楚生物医药有限公司	13477033894 027-65528557	陈经理	3821225285	询单

3,5-二甲基-4-氨基苯酚(3096-70-6)上下游

N-(4-羟基-2,6-二甲基苯基)乙酰胺

3,5-二甲基-4-氨基苯酚(3096-70-6)相关文献

1. Sterically congested molecules. Part 2. Structure of N-(2,2,5,5-tetramethylcyclopentylidene)-4-amino-3,5-dimethylphenol: accommodation of front strain along the CN double bond
Rudolf Knorr,Kurt Polborn J. Chem. Soc. Perkin Trans. 2 1991 1505
2. Index pages
J. Chem. Soc. Perkin Trans. 2 1991 A001
3. Notes
B. N. Figgis,R. S. Nyholm,D. Nasipuri,B. E. Betts,W. Davey,M. A. P. Hogg,J. E. Spice,E. Boyland,Peter Sims,M. M. Coombs,J. Lamy,Denise Lavit,Ng. Ph. Buu-Ho?,S. J. W. Price,A. F. Trotman-Dickenson,D. J. Alner,A. G. Smeeth,Wadie Tadros,Alfy Badie Sakla,Moheb Sadek Ishak,F. C. Cooper,C. L. Arcus,P. A. Hallgarten,D. A. H. Taylor J. Chem. Soc. 1958 4190

3,5-二甲基-4-氨基苯酚(3096-70-6)参考资料

Reaxys RN：

2082260

Beilstein：

13(4)1855

PubChem CID：

76543

3,5-二甲基-4-氨基苯酚(3096-70-6) MSDS

基础信息

4-Amino-3,5-xylenol Revision number: 1
SAFETY DATA SHEET

Section 1. BASE INFORMATION
Product name: 4-Amino-3,5-xylenol

Revision number: 1

Section 2. HAZARDS IDENTIFICATION
  Classification of the GHS
  PHYSICAL HAZARDS        Not classified
  HEALTH HAZARDS
    Category 4
  Acute toxicity (Oral)
  Acute toxicity (Dermal)        Category 4
    Category 4
  Acute toxicity (Inhalation)
  Skin corrosion/irritation        Category 2
    Category 2A
  Serious eye damage/eye irritation
  ENVIRONMENTAL HAZARDS        Not classified
  GHS label elements
  Pictograms or hazard symbols
  Signal word        Warning
  Hazard statement        Harmful by inhalation, in contact with skin and if swallowed
    Causes skin irritation
    Causes serious eye irritation
  Precautionary statements
  [Prevention]        Avoid breathing.
    Use only outdoors or in a well-ventilated area.
    Do not eat, drink or smoke when using this product.
    Wash hands thoroughly after handling.
    Wear protective gloves and eye/face protection.
    IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for
  [Response]
    breathing. Call a POISON CENTER or doctor/physician if you feel unwell.
    IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
    Rinse mouth.
    IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,
    if present and easy to do. Continue rinsing.
    If eye irritation persists: Get medical advice/attention.
    IF ON SKIN: Gently wash with plenty of soap and water.
    If skin irritation occurs: Get medical advice/attention.
    Wash contaminated clothing before reuse.
    Call a POISON CENTER or doctor/physician if you feel unwell.
  [Disposal]        Dispose of contents/container through a waste management company authorized by
    the local government
  4-Amino-3,5-xylenol

Section 3. COMPOSITION/INFORMATION ON INGREDIENTS
  Substance/mixture:        Substance
  Component(s):        4-Amino-3,5-xylenol
  Percent:        >98.0%(GC)(T)
  CAS Number:        3096-70-6
  Synonyms:        4-Amino-3,5-dimethylphenol , 4-Hydroxy-2,6-dimethylaniline
  Chemical Formula:        C8H11NO

Section 4. FIRST AID MEASURES
  Inhalation:        Remove victim to fresh air and keep at rest in a position comfortable for breathing.
    Call a POISON CENTER or doctor/physician if you feel unwell.
  Skin contact:        Remove/Take off immediately all contaminated clothing. Gently wash with plenty of
    soap and water. If skin irritation or rash occurs: Get medical advice/attention.
  Eye contact:        Rinse cautiously with water for several minutes. Remove contact lenses, if present
    and easy to do. Continue rinsing. If eye irritation persists: Get medical
    advice/attention.
  Ingestion:        Call a POISON CENTER or doctor/physician if you feel unwell. Rinse mouth.
    A rescuer should wear personal protective equipment, such as rubber gloves and air-
  Protection of first-aiders:
    tight goggles.

Section 5. FIRE-FIGHTING MEASURES
  Suitable extinguishing        Dry chemical, foam, water spray, carbon dioxide.
  media:
  Specific hazards:        Take care as it may decompose upon combustion or in high temperatures to
    generate poisonous fume.
  Specific methods:        Fire-extinguishing work is done from the windward and the suitable fire-extinguishing
    method according to the surrounding situation is used. Uninvolved persons should
    evacuate to a safe place. In case of fire in the surroundings: Remove movable
    containers if safe to do so.
  Special protective        When extinguishing fire, be sure to wear personal protective equipment.
  equipment for firefighters:

Section 6. ACCIDENTAL RELEASE MEASURES
  Personal precautions,        Use personal protective equipment. Keep people away from and upwind of spill/leak.
  protective equipment and Entry to non-involved personnel should be controlled around the leakage area by
  emergency procedures: roping off, etc.
  Environmental precautions: Prevent product from entering drains.
  Methods and materials for Sweep dust to collect it into an airtight container, taking care not to disperse it.
  containment and cleaning Adhered or collected material should be promptly disposed of, in accordance with
  up: appropriate laws and regulations.

Section 7. HANDLING AND STORAGE
  Handling
  Technical measures:        Handling is performed in a well ventilated place. Wear suitable protective equipment.
    Prevent dispersion of dust. Wash hands and face thoroughly after handling.
    Use a local exhaust if dust or aerosol will be generated.
  Advice on safe handling:        Avoid contact with skin, eyes and clothing.
  Storage
  Storage conditions:        Keep container tightly closed. Store in a cool and dark place.
    Store under inert gas.
    Store away from incompatible materials such as oxidizing agents.
  Packaging material:        Law is followed.
  4-Amino-3,5-xylenol

Section 8. EXPOSURE CONTROLS / PERSONAL PROTECTION
  Engineering controls:        Install a closed system or local exhaust as possible so that workers should not be
    exposed directly. Also install safety shower and eye bath.
  Personal protective equipment
  Respiratory protection: Dust respirator. Follow local and national regulations.
  Hand protection:        Protective gloves.
    Safety glasses. A face-shield, if the situation requires.
  Eye protection:
  Skin and body protection: Protective clothing. Protective boots, if the situation requires.

Section 9. PHYSICAL AND CHEMICAL PROPERTIES
  Physical state (20°C):        Solid
    crystal - powder
  Form:
  Color:        White - Greyish reddish yellow
    No data available
  Odor:
  pH: No data available
  Melting point/freezing point:181 °C
  Boiling Point/Range:        No data available
  Flash Point:        No data available
  Explosive limits
    No data available
  Lower:
  Upper:        No data available
    No data available
  Density:
  Solubility:        Soluble in : Methanol

Section 10. STABILITY AND REACTIVITY
  Stability:        Stable under proper conditions.
  Reactivity:        No special reactivity has been reported.
  Conditions to avoid:        Light-sensitive, Air-sensitive
  Incompartible materials: oxidizing agents
  Hazardous Decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx)
  Products:

Section 11. TOXICOLOGICAL INFORMATION
  Acute Toxicity:        orl-cat LDLo:412 mg/kg
    orl-rat LD:>500 mg/kg
  Skin corrosion/irritation: No data available
    No data available
  Serious eye
  damage/irritation:
  Germ cell mutagenicity: No data available
  Carcinogenicity:
    No data available
  IARC =
  NTP =        No data available
    No data available
  Reproductive toxicity:
  RTECS Number:        ZE6740000

Section 12. ECOLOGICAL INFORMATION
  Ecotoxicity:
  Fish:        No data available
  Crustacea:        No data available
  Algae:        No data available
  Persistence / degradability: No data available
  Bioaccumulative        No data available
  potential(BCF):
  Mobillity in soil
  log Pow:        No data available
  Soil adsorption (Koc):        No data available
  4-Amino-3,5-xylenol

Section 12. ECOLOGICAL INFORMATION
Henry's Law No data available
constant(PaM3/mol):

Section 13. DISPOSAL CONSIDERATIONS
    Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material
    with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system.
    Observe all federal, state and local regulations when disposing of the substance.

Section 14. TRANSPORT INFORMATION
  Hazards Class:        Does not correspond to the classification standard of the United Nations
    Not Listed
  UN-No:

Section 15. REGULATORY INFORMATION
  Safe management ordinance of dangerous chemical product (State Council announces on January 26,
  2002): Safe use and production, the storage of a dangerous chemical, transport, loading and unloading were
    prescribed.

SECTION 16 - ADDITIONAL INFORMATION
N/A