Benzamide, 4-chloro-N-methyl- 分子结构式
HCID101339

Benzamide, 4-chloro-N-methyl-

4-chloro-N-methylbenzamide

C8H8ClNO169.61 g/molCAS 6873-44-5

IDENTITY

结构与身份

标准SMILES
CNC(=O)c1ccc(Cl)cc1
InChIKey
DYDRCANRNSAYJA-UHFFFAOYSA-N
分子式
C8H8ClNO
平均分子量
169.61 g/mol
单同位素质量
169.0294416

COMPUTED

结构计算性质

已同步
XLogP
1.8
极性表面积
29.1 Ų
氢键供体
1
氢键受体
1
可旋转键
1
重原子
11
形式电荷
0
复杂度
141

GHS

GHS分类

来源:PubChem
GHS Classification

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P330, P332+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 Dam. 1 (100%);STOT SE 3 (100%)

ALIASES

名称与别名

共 32 条
6873-44-5Benzamide, 4-chloro-N-methyl-DTXSID90218859RefChem:1078002DTXCID901413504-chloro-N-methylbenzamideMFCD007744854-Chloro-N-methyl-benzamideN-Methyl-4-chlorobenzamideNSC406901NSC 406901AI3-09669N-Methyl 4-chlorobenzamideSCHEMBL79445SCHEMBL2354334-Chlorobenzamide, N-methyl-orb3027254SCHEMBL1987275SCHEMBL3617819SCHEMBL3822405

REACTIONS

参与反应

19
HRID 370912 反应方程式

uspto-grants-1985_07 · 10.6084/m9.figshare.5104873.v1 · US04528382

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HRID 655827 反应方程式

uspto-grants-2011_12 · 10.6084/m9.figshare.5104873.v1 · US08071618B2

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HRID 655828 反应方程式

uspto-grants-2011_12 · 10.6084/m9.figshare.5104873.v1 · US08071618B2

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HRID 690251 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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HRID 866504 反应方程式

uspto-grants-1978_07 · 10.6084/m9.figshare.5104873.v1 · US04099012

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HRID 1091430 反应方程式

uspto-grants-2012_03 · 10.6084/m9.figshare.5104873.v1 · US08129381B2

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HRID 1091431 反应方程式

uspto-grants-2012_03 · 10.6084/m9.figshare.5104873.v1 · US08129381B2

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HRID 1116647 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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