反应SMILES:CNS(=O)(=O)c1ccc(Br)c(C)c1
HCID8468070

4-bromo-N,3-dimethylbenzenesulfonamide

C8H10BrNO2S264.14 g/molCAS 923148-87-2

IDENTITY

结构与身份

标准SMILES
CNS(=O)(=O)c1ccc(Br)c(C)c1
InChIKey
VKXILHHKRMMVQB-UHFFFAOYSA-N
分子式
C8H10BrNO2S
平均分子量
264.14 g/mol
单同位素质量
262.96156

COMPUTED

结构计算性质

已同步
XLogP
1.9
极性表面积
54.6 Ų
氢键供体
1
氢键受体
3
可旋转键
2
重原子
13
形式电荷
0
复杂度
260

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

HAZARDS

危害信息

来源:PubChem
Hazard Classes and Categories

Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)

ALIASES

名称与别名

共 27 条
4-bromo-N,3-dimethylbenzenesulfonamide923148-87-2DTXSID50429166RefChem:291034DTXCID90380000N-METHYL 4-BROMO-3-METHYLBENZENESULFONAMIDE4-bromo-N,3-dimethylbenzene-1-sulfonamideMFCD08868519N-methyl-4-bromo-3-methylbenzenesulfonamideSCHEMBL710212SCHEMBL2371658VKXILHHKRMMVQB-UHFFFAOYSA-NYLB14887AKOS0051409764-Bromo-3,N-dimethylbenzenesulfonamide4-bromo-N,3-dimethyl-benzenesulfonamideBS-24680DB-0885564-bromo-3-methyl-N-methyl-benzenesulfonamideCS-0212249

REACTIONS

参与反应

0

当前筛选下没有反应记录。