CAS 924911-13-7 2-(1-methyl-1H-pyrazol-5-yl)ethan-1-ol (HCID 21832419)

基本情報

CAS: 924911-13-7
標準SMILES: Cn1nccc1CCO
InChIKey: JOVMMHAXQLTITC-UHFFFAOYSA-N
分子式: C6H10N2O
平均分子量: 126.16 g/mol

名称と識別子

優先名称: 2-(1-methyl-1H-pyrazol-5-yl)ethan-1-ol
IUPAC: 2-(2-methylpyrazol-3-yl)ethanol
英語名: 2-(1-Methyl-1H-pyrazol-5-yl)ethanol
分子式: C6H10N2O
分子量: 126.16

名称と別名

2-(1-methyl-1H-pyrazol-5-yl)ethan-1-ol924911-13-7RefChem:451093858-407-12-(1-methyl-1H-pyrazol-5-yl)ethanol2-(2-METHYLPYRAZOL-3-YL)ETHANOLSCHEMBL2264888SCHEMBL2493702JOVMMHAXQLTITC-UHFFFAOYSA-NZLB91113AKOS013279719AT15967

名称をさらに表示

1-Methyl-1H-pyrazole-5-ethanol1H-Pyrazole-5-ethanol, 1-methyl-

2-(2-Methyl-2H-pyrazol-3-yl)-ethanolDB-301630CS-0070340EN300-106108F511729F1905-0527Z1183446153

データベース識別子

CAS: 924911-13-7
PubChem CID: 21832419
EC Number: 858-407-1
Nikkaji: J2.598.392K

物性

構造計算による物性

XLogP: -0.2
極性表面積: 38.1 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: 2
重原子数: 9
形式電荷: 0
複雑度: 87.1

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.