166386-48-7 (4-甲烷磺酰苯硼酸,(4-methanesulfinylphenyl)boronic acid)

快速询单

结构式：

4-甲烷磺酰苯硼酸MOL文件

CAS号：

166386-48-7

中文名称：

4-甲烷磺酰苯硼酸

英文名称：

(4-methanesulfinylphenyl)boronic acid

分子式：

C₇H₉BO₃S

分子量：

184.020560979843

4-甲烷磺酰苯硼酸(166386-48-7)名称与标识符

名称

中文别名：

4-甲烷磺酰苯硼酸;3-氨基香豆素;4-甲烷磺酰基苯硼酸;4-(甲亚磺酰)苯硼酸;4-甲烷磺酰苯硼酸,98%;

英文别名：

(4-(Methylsulfinyl)phenyl)boronic acid;4-Boronophenyl methyl sulphoxide~4-(Methylsulphinyl)phenylboronic acid;4-(Methylsulfonyl)phenylboronic acid;4-(METHANESULFINYL)BENZENEBORONIC ACID;4-(Methylsulfinylphenyl)boronic acid;4-Methylsufinylphenyl boronic acid;(4-methylsulfinylphenyl)boronic acid;4-(Methylsulfinyl)benzeneboronic acid;AKOS BRN-0326;4-Boronophenylmethylsulfoxide;4-(METHYLSULFINYL)PHENYLBORONIC ACID;4-METHANESULPHINYLPHENYLBORONIC ACID;4-(METHYLSULPHINYL)PHENYLBORONIC ACID;4-(Methanesulfinyl)phenylboronic acid;4-(Methylsulphinyl)benzeneboronic acid;4-(METHANESULPHINYL)BENZENEBORONIC ACID;4-Methylsufinylphenylboronic acid;(4-methanesulfinylphenyl)boronic acid;(+/-)-[4-(methylsulfinyl)phenyl]boronic acid;4-Methylsulfinylbenzene boronic acid;MFCD02093071;SY019322;AB10761;F87169;YOTGALZTDVXUKZ-UHFFFAOYSA-N;SCHEMBL387447;4-Methylsulfinyl benzene boronic acid;J-513771;(4-(Methylsulfinyl)phenyl)boronicacid;[4-(Methanesulfinyl)phenyl]boronic acid;Boronic acid, [4-(methylsulfinyl)phenyl]-;4-(Methylsulfinyl)phenylboronic acid, AldrichCPR;166386-48-7;[4-(Methylsulphinyl)phenyl]boronic acid;CS-0176168;Boronic acid, B-[4-(methylsulfinyl)phenyl]-;A810727;AS-66038;AKOS004116476;4-(methylsulfinyl)phenyl boronic acid;FT-0616797;4-Methylsulfinylphenylboronic acid;DTXSID60378530;4-methanesulfinylphenylboronic acid;DB-010631;

标识符

MDL：

MFCD02093071

InChIKey：

YOTGALZTDVXUKZ-UHFFFAOYSA-N

Inchi：

1S/C7H9BO3S/c1-12(11)7-4-2-6(3-5-7)8(9)10/h2-5,9-10H,1H3

SMILES：

S(C)(C1C=CC(B(O)O)=CC=1)=O

4-甲烷磺酰苯硼酸(166386-48-7)物化性质

实验特性

LogP : -0.03050
PSA : 76.74000
折射率 : 1.616
沸点 : 416.8 ℃ at 760 mmHg
熔点 : 178-180°C
蒸气压 : 0.0±1.1 mmHg at 25°C
闪点 : 223.2°C
颜色与性状 : 白色粉末
溶解性 : 未确定
密度 : 1.39

计算特性

精确分子量 : 184.03700
氢键供体数量 : 2
氢键受体数量 : 3
可旋转化学键数量 : 2
同位素质量 : 184.037
重原子数量 : 12
复杂度 : 166
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 : 1
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 : 无
表面电荷 : 0
拓扑分子极性表面积 : 76.7A^2

4-甲烷磺酰苯硼酸(166386-48-7)安全信息

安全术语： S26;S36
安全说明： S26-S36/37/39
风险术语： R36/37/38
危害声明：H303+H313+H333
警示性声明：P264+P280+P305+P351+P338+P337+P313
储存条件： Sealed in dry,2-8°C
危险类别码： 36/37/38-36
信号词： warning

4-甲烷磺酰苯硼酸(166386-48-7)推荐厂家更多厂家(14)

公司名称	手机号/电话	联系人	QQ	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
上海腾准生物科技有限公司	19821570922 021-34053661	张经理	3003871136	询单
上海绩祥生物科技有限公司	18605105771	李经理	1799924424	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
广东元丰化学试剂有限公司	13380732450 0751-2829979	元丰化学小郑	3828157387	询单
上海吉至生化科技有限公司	18117592386 021-57481218	吉至试剂	3007522982	询单
上海麦克林生化科技股份有限公司	15221275939 021-50706066	沈经理	269348414	询单
南兴化工（江苏）有限公司	18651116180 0512-66387035	闵慧萍	3771156959	询单
广东翁江化学试剂有限公司	13927875076 0751-2815987	罗雪云	3007432263	询单
江苏艾康生物医药研发有限公司	18795912720 025-66061636	杨情情	3004779232	询单

4-甲烷磺酰苯硼酸(166386-48-7)上下游

4-甲硫基苯硼酸

4-甲烷磺酰苯硼酸(166386-48-7)参考资料

Beilstein：

M181944

PubChem CID：

2773531

4-甲烷磺酰苯硼酸(166386-48-7) MSDS

基础信息

Material Safety Data Sheet

Section 1. Identi?cation of the substance
Product Name: 4-Methylsul?nylphenylboronic acid
Synonyms:

Section 2. Hazards identi?cation
    Harmful by inhalation, in contact with skin, and if swallowed.
    H315:        Causes skin irritation
    H319:        Causes serious eye irritation
    H335:        May cause respiratory irritation
    P261:        Avoid breathing dust/fume/gas/mist/vapours/spray
    P280:        Wear protective gloves/protective clothing/eye protection/face protection
    P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present
    and easy to do – continue rinsing
    P304+P340:        IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing
    P405:        Store locked up

Section 3. Composition/information on ingredients.
Ingredient name: 4-Methylsul?nylphenylboronic acid
CAS number: 166386-48-7

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
    ?ushing of the eyes by separating the eyelids with ?ngers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

Section 5. Fire ?ghting measures
    In the event of a ?re involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator
    Hand precaution:        Wear suitable gloves/gauntlets
    Skin protection:        Wear suitable protective clothing
    Eye protection:        Wear suitable eye protection
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly quali?ed
    in the handling and use of potentially hazardous chemicals, who should take into account the ?re,
    health and chemical hazard data given on this sheet.
    Storage:        Store in closed vessels, refrigerated.

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Appearance:        Not speci?ed
    Boiling point:        No data
    Melting point:        No data
    Flash point:        No data
    Density:        No data
    Molecular formula: C7H9BO3S
    Molecular weight: 184.0

Section 10. Stability and reactivity
    Conditions to avoid: Heat, ?ames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, sulfur oxides.

Section 11. Toxicological information
No data.

Section 12. Ecological information
No data.

Section 13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
Non-harzardous for air and ground transportation.

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.

SECTION 16 - ADDITIONAL INFORMATION
N/A