CAS 1166994-78-0 Dicyclohexyl(9,10-dihydro-12-(2-methoxyphenyl)-9,10-ethenoanthracen-11-yl)phosphine (HCID 42604586)

기본 정보

CAS: 1166994-78-0
표준 SMILES: COc1ccccc1C1=C(P(C2CCCCC2)C2CCCCC2)C2c3ccccc3C1c1ccccc12
InChIKey: TWLOVWRCGQNALJ-UHFFFAOYSA-N
분자식: C35H39OP
평균 분자량: 506.7 g/mol
단동위원소 질량: 506.2738525

이름 및 식별자

우선 이름: Dicyclohexyl(9,10-dihydro-12-(2-methoxyphenyl)-9,10-ethenoanthracen-11-yl)phosphine
IUPAC: dicyclohexyl-[16-(2-methoxyphenyl)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaenyl]phosphane
현지명: 11-디사이클로헥실포스피노-12-(2-메톡시페닐)-9,10-에테노안트라센디클로로메탄부가물
영어명: 11-Dicyclohexylphosphino-12-(2-methoxyphenyl)-9,10-ethenoanthracene dichloromethane adduct, min. 98% o-MeO KITPHOS
분자식: C35H39OP
분자량: 506.66

이름 및 동의어

1166994-78-0Dicyclohexyl[9,10-dihydro-12-(2-methoxyphenyl)-9,10-ethenoanthracen-11-yl]phosphineDicyclohexyl(9,10-dihydro-12-(2-methoxyphenyl)-9,10-ethenoanthracen-11-yl)phosphineRefChem:337504dicyclohexyl-[16-(2-methoxyphenyl)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaenyl]phosphaneDTXSID001129667CS-008779311-Dicyclohexylphosphino-12-(2-methoxyphenyl)-9,10-ethenoanthracene dichloromethane adductDicyclohexyl[12-(2-methoxyphenyl)-9,10-dihydro-9,10-ethenoanthracen-11-yl]phosphane11-디사이클로헥실포스피노-12-(2-메톡시페닐)-9,10-에테노안트라센디클로로메탄부가물11-Dicyclohexylphosphino-12-(2-methoxyphenyl)-9,10-ethenoanthracenePhosphine, dicyclohexyl[9,10-dihydro-12-(2-methoxyphenyl)-9,10-ethenoanthracen-11-yl]-

이름 더 보기

11-Dicyclohexylphosphino-12-(2-Methoxyphenyl)-9,10-ethenoanthracene dichloroMethane adduct o-MeO-KITPHOS11-Dicyclohexylphosphino-12-(2-methoxyphenyl)-9,10-ethenoanthracene dichloromethane adduct, min. 98% o-MeO KITPHOS

물성

구조 계산 물성

XLogP: 8
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 5
무거운 원자 수: 37
형식 전하: 0
복잡도: 764

물리화학적 성질

끓는 점: 617.3 · 617.3±55.0 °C(Predicted)
물리적 상태: 가루
색상: 하얀색

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.