Pyridine-4-carbonyl chloride

HCID 417436CAS 39178-35-3

基本情報

標準SMILES: O=C(Cl)c1ccncc1
InChIKey: RVQZKNOMKUSGCI-UHFFFAOYSA-N
分子式: C6H4ClNO
平均分子量: 141.55 g/mol

名称と識別子

優先名称: Pyridine-4-carbonyl chloride
IUPAC: pyridine-4-carbonyl chloride

名称と別名

Pyridine-4-carbonyl chlorideEINECS 254-331-2NSC 91025RefChem:870750254-331-214254-57-04-Pyridinecarbonyl chlorideIsonicotinoyl chlorideisonicotinic acid chlorideMFCD01874350isonicotinoylchlorideisonicotinic chloride

名称をさらに表示

4-picolinoyl chlorideisonicotinoyl hydrochloride4-pyridylcarbonyl chloridepyrid4-ylcarbonyl chloride4-Pyridinecarbonvl chloridepyrid-4-ylcarbonyl chlorideSCHEMBL2196NCIOpen2_001530

データベース識別子

CAS: 39178-35-3
PubChem CID: 417436
EC Number: 254-331-2
Nikkaji: J27.987K

物性

構造計算による物性

XLogP: 1.4
極性表面積: 30 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 9
形式電荷: 0
複雑度: 110

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.