CAS 240417-00-9 2'-(diphenylphosphanyl)-N,N-dimethyl-[1,1'-biphenyl]-2-amine (HCID 2734939)

기본 정보

CAS: 240417-00-9
표준 SMILES: CN(C)c1ccccc1-c1ccccc1P(c1ccccc1)c1ccccc1
InChIKey: JGFXUYLYPITYGR-UHFFFAOYSA-N
분자식: C26H24NP
평균 분자량: 381.4 g/mol
단동위원소 질량: 381.1646364

이름 및 식별자

우선 이름: 2'-(diphenylphosphanyl)-N,N-dimethyl-[1,1'-biphenyl]-2-amine
IUPAC: 2-(2-diphenylphosphanylphenyl)-N,N-dimethylaniline
영어명: 2-Diphenylphosphino-2'-(N,N-dimethylamino)biphenyl
분자식: C26H24NP
분자량: 381.45

이름 및 동의어

2-(DIPHENYLPHOSPHINO)-2'-(N,N-DIMETHYLAMINO)BIPHENYL2'-(diphenylphosphanyl)-N,N-dimethyl-[1,1'-biphenyl]-2-amine2'-(diphenylphosphanyl)-N,N-dimethyl-(1,1'-biphenyl)-2-amineRefChem:439538607-309-5240417-00-92-Diphenylphosphino-2'-(N,N-dimethylamino)biphenylPhDave-PhosMFCD030945782-(2-diphenylphosphanylphenyl)-N,N-dimethylanilineC26H24NP2-(2-diphenylphosphanylphenyl)-N,N-dimethyl-aniline

이름 더 보기

PhDave-Phos 97%2-Diphenylphosphino-2(N,N-DIMETHYLAMINO)BIPHENYL2-Diphenylphosphino-2'-(N,N-di2-Diphenylphosphino-2`-dimethylaminobiphenyl2-DiphenylphosphiNA-2'-(N,N-diMethylaMiNA)biphenyl[2-(2-Dimethylaminophenyl)phenyl]diphenylphosphine

2-Dimethylamino-2'-(diphenylphosphino)biphenyl2-(diphenylphosphino)-2'(N,N-dimethylamino)biphenyl2'-(DIPHENYLPHOSPHINO)-N,N'-DIMETHYL-(1,1'-BIPHENYL)-2-AMINEPHDAVEPHOSAMY42209PhDave-Phos, 97%[1,1'-BIPHENYL]-2-AMINE, 2'-(DIPHENYLPHOSPHINO)-N,N-DIMETHYL-SCHEMBL229536

물성

구조 계산 물성

XLogP: 6.4
극성 표면적: 3.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 5
무거운 원자 수: 28
형식 전하: 0
복잡도: 433

물리화학적 성질

녹는점: 126 · 126-128 °C
끓는 점: 514.6 · 514.6±43.0 °C(Predicted)
저장 조건: Inert atmosphere,Room Temperature
산도 계수 (pKa): 4.96 · 4.96±0.18(Predicted)
물리적 상태: 분말, 결정, 결정질 분말 및/또는 덩어리
색상: 흰색에서 노란색으로
수용성: 불용성
InChI: 1S/C26H24NP/c1-27(2)25-19-11-9-17-23(25)24-18-10-12-20-26(24)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22/h3-20H,1-2H3
InChIKey: JGFXUYLYPITYGR-UHFFFAOYSA-N
SMILES: CN(C)c1ccccc1-c2ccccc2P(c3ccccc3)c4ccccc4

화학적 성질

white to yellow powder, crystals, crystalline

안전 및 규제

GHS 분류

GHS Classification · 4건

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)

Aggregated GHS information provided per 76 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.