CAS 2001-23-2 1-(1,1'-Biphenyl)-4-yl-2-phenylethan-1-one (HCID 74817)

基本情報

CAS: 2001-23-2
標準SMILES: O=C(Cc1ccccc1)c1ccc(-c2ccccc2)cc1
InChIKey: FNOSNNPSTLUBPC-UHFFFAOYSA-N
分子式: C20H16O
平均分子量: 272.3 g/mol
単同位体質量: 272.12011513

名称と識別子

優先名称: 1-(1,1'-Biphenyl)-4-yl-2-phenylethan-1-one
IUPAC: 2-phenyl-1-(4-phenylphenyl)ethanone
現地名: 1-(4-ビフェニリル)-2-フェニルエタノン
英語名: 1-[1,1'-biphenyl]-4-yl-2-phenylethan-1-one
分子式: C20H16O
分子量: 272.34

名称と別名

2001-23-21-[1,1'-biphenyl]-4-yl-2-phenylethan-1-oneEINECS 217-888-21-(1,1'-Biphenyl)-4-yl-2-phenylethan-1-oneDTXSID40173823RefChem:419162DTXCID4096314217-888-21-([1,1'-Biphenyl]-4-yl)-2-phenylethanone1-(biphenyl-4-yl)-2-phenylethanone2-phenyl-1-(4-phenylphenyl)ethanone1-(4-Biphenylyl)-2-phenylethanone

名称をさらに表示

1-(4-ビフェニリル)-2-フェニルエタノン1-[[1,1'-ビフェニル]-4-イル]-2-フェニルエタノン4-フェニルデオキシベンゾイン1-{[1,1'-ビフェニル]-4-イル}-2-フェニルエタン-1-オン4-(フェニルアセチル)ビフェニル1-[[1,1′-ビフェニル]-4-イル]-2-フェニルエタノン1-(ビフェニル-4-イル)-2-フェニルエタノン1-([1,1'-biphenyl]-4-yl)-2-phenylethylone

MFCD00228055Ethanone, 1-[1,1'-biphenyl]-4-yl-2-phenyl-1-{[1,1'-biphenyl]-4-yl}-2-phenylethan-1-one1-biphenyl-4-yl-2-phenylethanone1-BIPHENYL-4-YL-2-PHENYL-ETHANONE1-([1,1'-Biphenyl]-4-yl)-2-phenylethan-1-one4-Phenyldeoxybenzoin1-[[1,1'-Biphenyl]-4-yl]-2-phenylethanone

データベース識別子

CAS: 2001-23-2
PubChem CID: 74817
DTXSID: DTXSID40173823
UNII: MHJ2G8A42S
EC Number: 217-888-2
Nikkaji: J199.811K

物性

構造計算による物性

XLogP: 4.8
極性表面積: 17.1 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 4
重原子数: 21
形式電荷: 0
複雑度: 315

物理化学的性質

融点: 139 °C · 139 °C
沸点: 436.6 · 436.6±14.0 °C(Predicted)
比重(密度): 1.102 · 1.102±0.06 g/cm3(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.