CAS 794527-14-3 2-(Dicyclohexylphosphanyl)-1-(2,4,6-trimethylphenyl)-1H-imidazole (HCID 53411819)

기본 정보

CAS: 794527-14-3
표준 SMILES: Cc1cc(C)c(-n2ccnc2P(C2CCCCC2)C2CCCCC2)c(C)c1
InChIKey: ZRVANNJGPCSNAH-UHFFFAOYSA-N
분자식: C24H35N2P
평균 분자량: 382.5 g/mol
단동위원소 질량: 382.25378575

이름 및 식별자

우선 이름: 2-(Dicyclohexylphosphanyl)-1-(2,4,6-trimethylphenyl)-1H-imidazole
IUPAC: dicyclohexyl-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]phosphane
영어명: 2-(Dicyclohexylphosphino)-1-(2,4,6-trimethyl-phenyl)-1H-imidazole
분자식: C24H35N2P
분자량: 382.52

이름 및 동의어

794527-14-3DTXSID006965082-(Dicyclohexylphosphanyl)-1-(2,4,6-trimethylphenyl)-1H-imidazoleRefChem:253710DTXCID006472572-(Dicyclohexylphosphino)-1-mesityl-1H-imidazole2-(DICYCLOHEXYLPHOSPHINO)-1-(2,4,6-TRIMETHYL-PHENYL)-1H-IMIDAZOLEMFCD066581251-(2,4,6-Trimethylphenyl)-2-(dicyclohexylphosphino)imidazoledicyclohexyl-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]phosphaneSCHEMBL289539C24H35N2P

이름 더 보기

cataCXium? PICy95% [cataCXiuM PlCy]Dicyclohexyl(1-mesityl-1H-imidazol-2-yl)phosphineicyclohexyl-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]phosphane1H-Imidazole, 2-(dicyclohexylphosphino)-1-(2,4,6-trimethylph...1-(2,4,6-Trimethylphenyl)-2-(dicyclohexylphosphino)imidazole,95%1H-Imidazole, 2-(dicyclohexylphosphino)-1-(2,4,6-trimethylphenyl)-

ZRVANNJGPCSNAH-UHFFFAOYSA-NAKOS016012175DB-3233541-mesityl-2-(dicyclohexyl-phosphino)imidazoleH579822-(Dicyclohexylphosphino)-1-(2,4,6-trimethyl-phenyl)-1H-imidazole, 95%

물성

구조 계산 물성

XLogP: 6.3
극성 표면적: 17.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 27
형식 전하: 0
복잡도: 427

물리화학적 성질

녹는점: 109 °C · 109°C
끓는 점: 538.2 · 538.2±60.0 °C(Predicted)
산도 계수 (pKa): 4.3 · 4.30±0.10(Predicted)
물리적 상태: 가루
색상: 하얀색
BRN: 9956113 · 9956113
InChI: 1S/C24H35N2P/c1-18-16-19(2)23(20(3)17-18)26-15-14-25-24(26)27(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h14-17,21-22H,4-13H2,1-3H3
InChIKey: ZRVANNJGPCSNAH-UHFFFAOYSA-N
SMILES: Cc1cc(C)c(c(C)c1)-n2ccnc2P(C3CCCCC3)C4CCCCC4