CAS 105755-37-1 4-chloro-N-hydroxybenzene-1-carbonimidoyl chloride (HCID 2755543)

基本情報

CAS: 105755-37-1
標準SMILES: ON=C(Cl)c1ccc(Cl)cc1
InChIKey: JPBNMRDGFBFKLT-UHFFFAOYSA-N
分子式: C7H5Cl2NO
平均分子量: 190.02 g/mol
単同位体質量: 188.9748192

名称と識別子

優先名称: 4-chloro-N-hydroxybenzene-1-carbonimidoyl chloride
IUPAC: 4-chloro-N-hydroxybenzenecarboximidoyl chloride
英語名: Benzenecarboximidoyl chloride, 4-chloro-N-hydroxy-, [C(E)]-
分子式: C7H5Cl2NO
分子量: 190.03

名称と別名

4-chloro-N-hydroxybenzenecarboximidoyl chloride4-chloro-N-hydroxybenzene-1-carbonimidoyl chlorideRefChem:521885870-951-1105755-37-14-chloro-N-hydroxy-benzimidoyl chloride4-Chloro-N-hydroxybenzimidoyl chlorideBenzenecarboximidoyl chloride, 4-chloro-N-hydroxy-SCHEMBL4369844-chlorobenzohydroximoyl chloride4-chloro-alpha-chlorobenzaldoximealpha-Chloro-4-chlorobenzaldoxime

名称をさらに表示

Benzenecarboximidoyl chloride, 4-chloro-N-hydroxy-, [C(E)]-

JPBNMRDGFBFKLT-UHFFFAOYSA-NXH1050AKOS0049100424-chloro-N-hydroxybenzenimidoyl chlorideDB-0920444-chloro-N-hydroxy-benzenecarboximidoyl chloride

データベース識別子

CAS: 105755-37-1、28123-63-9
PubChem CID: 2755543
EC Number: 870-951-1

物性

構造計算による物性

XLogP: 3.3
極性表面積: 32.6 Å²
水素結合供与体数: 1
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 11
形式電荷: 0
複雑度: 153

物理化学的性質

沸点: 304.8 · 304.8±44.0 °C(Predicted)
比重(密度): 1.38 · 1.38±0.1 g/cm3(Predicted)
酸解離定数(Pka): 10.48 · 10.48±0.11(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

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.