(5,5'-Dichloro-6,6'-dimethoxy-2,2'-biphenyldiyl)bis(diphenylphosphine)

HCID 5165044CAS 185913-97-7

기본 정보

표준 SMILES: COc1c(Cl)ccc(P(c2ccccc2)c2ccccc2)c1-c1c(P(c2ccccc2)c2ccccc2)ccc(Cl)c1OC
InChIKey: GCBRCSSVOVNEIX-UHFFFAOYSA-N
분자식: C38H30Cl2O2P2
평균 분자량: 651.5 g/mol

이름 및 식별자

우선 이름: (5,5'-Dichloro-6,6'-dimethoxy-2,2'-biphenyldiyl)bis(diphenylphosphine)
IUPAC: [4-chloro-2-(3-chloro-6-diphenylphosphanyl-2-methoxyphenyl)-3-methoxyphenyl]-diphenylphosphane
영어명: (R)-(+)-5,5'-Dichloro-6,6'-dimethoxy-2,2'-bis(diphenylphosphino)-1,1'-biphenyl
분자식: C38H30Cl2O2P2
분자량: 651.5

이름 및 동의어

185913-98-8185913-97-7RefChem:403521(5,5'-Dichloro-6,6'-dimethoxy-2,2'-biphenyldiyl)bis(diphenylphosphine)5,5'-Dichloro-6,6'-dimethoxy-2,2'-biphenyldiyl)bis(diphenylphosphine)811-310-8811-677-4(S)-(-)-5,5'-Dichloro-6,6'-dimethoxy-2,2'-bis(diphenylphosphino)-1,1'-biphenyl(R)-MeO-Cl-BIPHEPMFCD03426987(R)-(5,5'-Dichloro-6,6'-dimethoxy-[1,1'-biphenyl]-2,2'-diyl)bis(diphenylphosphine)[4-chloro-2-(3-chloro-6-diphenylphosphanyl-2-methoxyphenyl)-3-methoxyphenyl]-diphenylphosphane

이름 더 보기

95.0% (H-NMR)(R)-(+)-5，5′-Dichloro-2，2′-dimethoxy-1，1′min.(r)-cl-meo-biphep-bis(diphenylphosphino)-6，6′(+)-5,5'-DICHLORO-2,2'-BIS(DIPHE.PHOS)6,6'-DIMETHOXYBIPHENYL

(S)-Cl-MeO-BIPHEP(r)-(+)-5,5'-dichloro-6,6'-dimethoxy-2,2'-bis(diphenylphosphino)-1,1'-biphenyl(R)-(+)-5,5/'-DICHLORO-6,6/'-DIMETHOXY-2,2/'-BIS(DIPHENYLPHOSPHINO)-1,1/'-BIPHENYL(R)-(-)-Cl-MeO-BIPHEP(S)-(-)-Cl-MeO-BIPHEP(R)-Cl-MeO-BIPHEP(5,5'-dichloro-6,6'-dimethoxy-[1,1'-biphenyl]-2,2'-diyl)bis(diphenylphosphane)(R)-(+)-Cl-MeO-BIPHEP

데이터베이스 식별자

CAS: 185913-97-7、185913-98-8
PubChem CID: 5165044
EC Number: 811-310-8、811-677-4
Nikkaji: J2.083.191J、J2.182.860B、J2.471.660K

물성

구조 계산 물성

XLogP: 10.1
극성 표면적: 18.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 9
무거운 원자 수: 44
형식 전하: 0
복잡도: 735

물리화학적 성질

녹는점: 176 · 176-180 °C
끓는 점: 678.2 · 678.2±55.0 °C(Predicted)
저장 조건: 2 · 2-8°C, protect from light, stored under nitrogen
물리적 상태: 가루
색상: 황백색
InChIKey: GCBRCSSVOVNEIX-UHFFFAOYSA-N
SMILES: C1(C(OC)=C(C=CC=1P(C1=CC=CC=C1)C1C=CC=CC=1)Cl)C1=C(OC)C(=CC=C1P(C1=CC=CC=C1)C1C=CC=CC=1)Cl

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 97.4% (37 of 38) of all reports.

Not Classified

Aggregated GHS information provided per 38 reports by companies from 2 notifications to the ECHA C&L Inventory.

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)