N-Methylsulfamoyl chloride 分子结构式
HCID11789235

N-Methylsulfamoyl chloride

CH4ClNO2S129.57 g/molCAS 10438-96-7

IDENTITY

结构与身份

标准SMILES
CNS(=O)(=O)Cl
InChIKey
UJJUEJRWNWVHCM-UHFFFAOYSA-N
分子式
CH4ClNO2S
平均分子量
129.57 g/mol
单同位素质量
128.9651272

COMPUTED

结构计算性质

已同步
XLogP
0.1
极性表面积
54.6 Ų
氢键供体
1
氢键受体
3
可旋转键
1
重原子
6
形式电荷
0
复杂度
110

GHS

GHS分类

来源:PubChem
GHS Classification

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H330 (92.9%): Fatal if inhaled [Danger Acute toxicity, inhalation];H351 (92.9%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P260, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P320, P321, P330, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

HAZARDS

危害信息

来源:PubChem
Hazard Classes and Categories

Acute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Corr. 1B (100%);Acute Tox. 2 (92.9%);Carc. 2 (92.9%)

ALIASES

名称与别名

共 31 条
10438-96-7N-methylsulfamoyl chlorideRefChem:830799600-562-2METHYLSULFAMOYL CHLORIDEMFCD00126938MethylsulfamoylchlorideSulfamoyl chloride, methyl-methyl sulfamoyl chloridemethylaminosulfonyl chlorideMesulfamoyl chlorideMethylsulfamoylchloridmethylsulfamyl choridemethylsulfamyl chlorideMethylsulphamoyl chlorideN-methylsulfamoylchloridemethylsulfamic acid chlorideN-methyl sulfamoyl chlorideN-Methylaminosulfonyl chlorideSCHEMBL573159

REACTIONS

参与反应

88
HRID 33364 反应方程式

uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07429595B2

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HRID 65816 反应方程式

uspto-grants-1978_12 · 10.6084/m9.figshare.5104873.v1 · US04128551

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HRID 66040 反应方程式

uspto-grants-1978_12 · 10.6084/m9.figshare.5104873.v1 · US04129734

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HRID 66045 反应方程式

uspto-grants-1978_12 · 10.6084/m9.figshare.5104873.v1 · US04129733

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HRID 122917 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID 186249 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID 257321 反应方程式

uspto-grants-1993_11 · 10.6084/m9.figshare.5104873.v1 · US05262382

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HRID 293356 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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