2-Dicyclohexylphosphino-2',6'-diisopropoxybiphenyl

HCID 16217985CAS 787618-22-8

기본 정보

표준 SMILES: CC(C)Oc1cccc(OC(C)C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1
InChIKey: MXFYYFVVIIWKFE-UHFFFAOYSA-N
분자식: C30H43O2P
평균 분자량: 466.6 g/mol
단동위원소 질량: 466.30006761

이름 및 식별자

우선 이름: 2-Dicyclohexylphosphino-2',6'-diisopropoxybiphenyl
IUPAC: dicyclohexyl-[2-[2,6-di(propan-2-yloxy)phenyl]phenyl]phosphane
영어명: 2-Dicyclohexylphosphino-2',6'-diisopropoxybiphenyl
분자식: C30H43O2P
분자량: 466.64

이름 및 동의어

2-Dicyclohexylphosphino-2',6'-diisopropoxybiphenylRefChem:471295616-653-5787618-22-8Dicyclohexyl(2',6'-diisopropoxy-[1,1'-biphenyl]-2-yl)phosphine2-DICYCLOHEXYLPHOSPHINO-2',6'-DIISOPROPOXY-1,1'-BIPHENYL2-Dicyclohexylphosphino-2,6-DI-I-Propoxy-1,1-Biphenyl2-DICYCLOHEXYLPHOSPHINO-2',6'-DI-I-PROPOXY-1,1'-BIPHENYLMFCD06798294Ruphos phosphine ligand [MI]2-(Dicyclohexylphosphino)-2',6'-isopropoxybiphenylC30H43O2P

이름 더 보기

RUPHOS98% RuPhos2-Dicydicyclohexyl(2',6'-diisopropoxybiphenyl-2-yl)phosphine2-Dicyclohexylphosphino-2',6'-di-i-propoxy-1,1'-bipheny

dicyclohexyl-[2-(2,6-diisopropoxyphenyl)phenyl]phosphanedicyclohexyl-[2-[2,6-di(propan-2-yloxy)phenyl]phenyl]phosphaneX3474RY19EBuchwald phosphine ligands, ruphos phosphine ligand-2-(Dicyclohexylphosphino)-2',6'-di-isopropoxy-1,1'-biphenyldicyclohexyl(2',6'-diisopropoxy-[1,1'-biphenyl]-2-yl)phosphanePhosphine, (2',6'-bis(1-methylethoxy)(1,1'-biphenyl)-2-yl)dicyclohexyl-2-Dicyclohexylphosphino-2,6-diisopropoxybiphenyl

데이터베이스 식별자

CAS: 787618-22-8
PubChem CID: 16217985
DTXSID: DTXSID10584700
UNII: X3474RY19E
EC Number: 616-653-5
Nikkaji: J2.226.608J

물성

구조 계산 물성

XLogP: 8.3
극성 표면적: 18.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 8
무거운 원자 수: 33
형식 전하: 0
복잡도: 515

물리화학적 성질

녹는점: 123 · 123-124°C
끓는 점: 551.7 · 551.7±40.0 °C(Predicted)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: 클로로포름(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 가루
색상: 하얀색
InChI: InChI=1S/C30H43O2P/c1-22(2)31-27-19-13-20-28(32-23(3)4)30(27)26-18-11-12-21-29(26)33(24-14-7-5-8-15-24)25-16-9-6-10-17-25/h11-13,18-25H,5-10,14-17H2,1-4H3
InChIKey: MXFYYFVVIIWKFE-UHFFFAOYSA-N
SMILES: P(C1=CC=CC=C1C1=C(OC(C)C)C=CC=C1OC(C)C)(C1CCCCC1)C1CCCCC1

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (90.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (90.6%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (13.2%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (13.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (90.6%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (11.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H413 (86.8%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (90.6%)；Acute Tox. 4 (90.6%)；Skin Irrit. 2 (13.2%)；Eye Irrit. 2A (13.2%)；Acute Tox. 4 (90.6%)；STOT SE 3 (11.3%)；Aquatic Chronic 4 (86.8%)