2-[Bis(1-adamantyl)phosphino]biphenyl

HCID 9868588

ノート反応

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基本情報

CAS: 224311-55-1
標準SMILES: c1ccc(-c2ccccc2P(C23CC4CC(CC(C4)C2)C3)C23CC4CC(CC(C4)C2)C3)cc1
InChIKey: MSKLBRMTWIUCEQ-UHFFFAOYSA-N
分子式: C32H39P
平均分子量: 454.6 g/mol

名称と識別子

優先名称: 2-[Bis(1-adamantyl)phosphino]biphenyl
IUPAC: bis(1-adamantyl)-(2-phenylphenyl)phosphane
英語名: [1,1′-Biphenyl]-2-yldi[(3S,5S,7S)-1-adamantanyl]phosphine
分子式: C32H39P
分子量: 454.63

名称と別名

224311-55-1(2-Biphenyl)di-1-adamantylphosphine[1,1'-Biphenyl]-2-yldi(adamantan-1-yl)phosphine2-[Bis(1-adamantyl)phosphino]biphenylBis(1-adamantyl)-(2-phenylphenyl)phosphaneMFCD28100470[1,1 inverted exclamation marka-Biphenyl]-2-yldi[(3S,5S,7S)-1-adamantanyl]phosphineSCHEMBL4433788C32H39PMSKLBRMTWIUCEQ-UHFFFAOYSA-N2-(di-1-adamantylphosphino)biphenyl2-Biphenylyldi(1-adamantyl)phosphine

名称をさらに表示

2-(Bis(adamant-1-yl)phosphino)biphenyl2-[Diphenylphosphine-1-undecyl]benzene(2-Biphenyl)di-1-adamantylphosphine 97%1,1'-Biphenyl]-2-yldi(adamantan-1-yl)phosphineBiphenyl]-2-yldi[(3S,5S,7S)-1-adamantanyl]phosphine[1,1′-Biphenyl]-2-yldi[(3S,5S,7S)-1-adamantanyl]phosphinePhosphine, [1,1'-biphenyl]-2-ylbis(tricyclo[3.3.1.13,7]dec-1-yl)-

2-(di- 1-adamantylphosphino)biphenylSY279477CS-0108697E81299[1,1'-biphenyl]-2-yldi(adamantan-1-yl)phosphaneF870266[1,1'-Biphenyl]-2-yldi[(3S,5S,7S)-1-adamantanyl]phosphine[1,1?-Biphenyl]-2-yldi[(3S,5S,7S)-1-adamantanyl]phosphine

データベース識別子

CAS: 224311-55-1
PubChem CID: 9868588
EC Number: 803-343-1
Nikkaji: J1.124.979E

物性

構造計算による物性

XLogP: 8.5
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 4
重原子数: 33
形式電荷: 0
複雑度: 619

物理化学的性質

融点: 220 · 220-225°C
貯蔵温度: 2 · 2-8°C, protect from light, stored under nitrogen
InChI: InChI=1S/C32H39P/c1-2-6-28(7-3-1)29-8-4-5-9-30(29)33(31-16-22-10-23(17-31)12-24(11-22)18-31)32-19-25-13-26(20-32)15-27(14-25)21-32/h1-9,22-27H,10-21H2
InChIKey: MSKLBRMTWIUCEQ-UHFFFAOYSA-N
SMILES: P(C1=CC=CC=C1C1=CC=CC=C1)(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P316, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.