CAS 34905-03-8 3-(2-Propyn-1-yloxy)benzenemethanol (HCID 10797067)

基本情報

CAS: 34905-03-8
標準SMILES: C#CCOc1cccc(CO)c1
InChIKey: CJSZXTASUDBDKP-UHFFFAOYSA-N
分子式: C10H10O2
平均分子量: 162.18 g/mol
単同位体質量: 162.06807956

名称と識別子

優先名称: 3-(2-Propyn-1-yloxy)benzenemethanol
IUPAC: (3-prop-2-ynoxyphenyl)methanol

名称と別名

[3-(prop-2-yn-1-yloxy)phenyl]methanol34905-03-8(3-(Prop-2-yn-1-yloxy)phenyl)methanolDTXSID5012943683-(2-Propyn-1-yloxy)benzenemethanolRefChem:491310DTXCID301724915836-352-4(3-prop-2-ynoxyphenyl)methanol3-propargyloxybenzyl alcoholMFCD11149488Benzenemethanol, 3-(2-propyn-1-yloxy)-

名称をさらに表示

SCHEMBL308414SCHEMBL31103834CJSZXTASUDBDKP-UHFFFAOYSA-NJBA90503AKOS000248074[3-(Prop-2-yn-1-yloxy)benzyl AlcoholSY186844{3-[(Prop-2-yn-1-yl)oxy]phenyl}methanol

データベース識別子

CAS: 34905-03-8
PubChem CID: 10797067
DTXSID: DTXSID501294368
EC Number: 836-352-4
Nikkaji: J1.119.730B

物性

構造計算による物性

XLogP: 1.3
極性表面積: 29.5 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: 3
重原子数: 12
形式電荷: 0
複雑度: 168

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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.