2-chloro-N'-hydroxyethanimidamide

HCID 4112252

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基本情報

CAS: 3272-96-6
標準SMILES: NC(CCl)=NO
InChIKey: XCARGDPHZYJCMU-UHFFFAOYSA-N
分子式: C2H5ClN2O
平均分子量: 108.53 g/mol

名称と識別子

優先名称: 2-chloro-N'-hydroxyethanimidamide
IUPAC: 2-chloro-N'-hydroxyethanimidamide
英語名: 2-Chloro-acetamide oxime
分子式: C2H5ClN2O
分子量: 108.53

名称と別名

RefChem:469809838-348-82-chloro-N'-hydroxyethanimidamidechloroacetamidoxime3272-96-62-chloro-N-hydroxyacetimidamide2-Chloro-N-hydroxyacetamidineC2H5ClN2O2-Chloro-N-hydroxy-acetamidine2-chloro-N'-hydroxy-acetamidinechloroacetamide oxime2-chloroacetamidoxime

名称をさらに表示

2-Chloro-acetamide oximeN-HYDROXY-CHLOROACETAMIDINE2-Chloro-N’-hydroxyacetimidamide2-chloro-N'-hydroxy-ethanimidamideEthanimidamide, 2-chloro-N-hydroxy-(Z)-2-chloro-N'-hydroxyacetimidamide(1Z)-2-Chloro-n'-hydroxyethanimidamide(1Z)-2-chloro-N′-hydroxyethanimidamide, CAS 3272-96-6

SCHEMBL3348892-chloro-N-hydroxyacetoamidineSCHEMBL15440152-chloro-N-hydroxyethanimidamideXCARGDPHZYJCMU-UHFFFAOYSA-NAKOS026676761DB-127726F372892

データベース識別子

CAS: 3272-96-6
PubChem CID: 4112252
EC Number: 838-348-8

物性

構造計算による物性

XLogP: 0
極性表面積: 58.6 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 6
形式電荷: 0
複雑度: 62.6

物理化学的性質

融点: 110 · 110-112 °C
沸点: 183.5 · 183.5±42.0 °C(Predicted)
比重(密度): 1.3932 · 1.3932 (rough estimate)
屈折率: 1.451 · 1.4510 (estimate)
酸解離定数(Pka): 13.11 · 13.11±0.50(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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.