기본 정보
- 표준 SMILES
CC1(C)C=C(B2OC(C)(C)C(C)(C)O2)C=C2C=c3cc4c5ccccc5c5ccccc5c4cc3=C21- InChIKey
OZZBPFWQVSIKNW-UHFFFAOYSA-N- 분자식
- C33H31BO2
- 평균 분자량
- 470.4 g/mol
이름 및 식별자
- 우선 이름
- 10,10-dimethyl-(10H-indeno[1,2-b]triphenylen-12-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- IUPAC
- 2-(18,18-dimethyl-20-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16,19,21,23-dodecaenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
이름 및 동의어
SCHEMBL15674619SCHEMBL29793978OZZBPFWQVSIKNW-UHFFFAOYSA-N10,10-dimethyl-(10H-indeno[1,2-b]triphenylen-12-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane2-(10,10-dimethyl -10H-indeno[1,2-b]triphenylen-12-yl) -4,4,5,5-tetramethyl-1,3,2 -dioxaborolane2-(10,10-dimethyl-10H-indeno[1,2-b]triphenylen-12-yl)-4,4,5,5-teramethyl-1,3,2-dioxaborolane2-(10,10-dimethyl-10H-indeno[1,2-b]triphenylen-12-yl)-4,4,5,5-tetra methyl-1,3,2-dioxaborolane2-(10,10-dimethyl-10H-indeno[1,2-b]triphenylen-12-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane2-(10,10-dimethyl-10H-indeno[1,2-b]triphenylene-12-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane2-(10,10-dimethyl-10H-indeno[2,1-b]triphenylen-12-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
데이터베이스 식별자
- PubChem CID
- 86718312
물성
구조 계산 물성
- 극성 표면적
- 18.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 1,180
관련 반응
13건
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