헥사토실레이트디펜타에릴트리톨
1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, tetrakis(4-methylbenzenesulfonate) (9CI)
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기본 정보
- CAS
214144-11-3- 표준 SMILES
Cc1ccc(S(=O)(=O)OCC(COCC(COS(=O)(=O)c2ccc(C)cc2)(COS(=O)(=O)c2ccc(C)cc2)COS(=O)(=O)c2ccc(C)cc2)(COS(=O)(=O)c2ccc(C)cc2)COS(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
FCWJZVHUZYAODT-UHFFFAOYSA-N- 분자식
- C52H58O19S6
- 평균 분자량
- 1,179.4 g/mol
- 단동위원소 질량
- 1,178.1896567
이름 및 식별자
- 우선 이름
- 1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, tetrakis(4-methylbenzenesulfonate) (9CI)
- IUPAC
- [3-(4-methylphenyl)sulfonyloxy-2-[[3-(4-methylphenyl)sulfonyloxy-2,2-bis[(4-methylphenyl)sulfonyloxymethyl]propoxy]methyl]-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate
- 현지명
- 헥사토실레이트디펜타에릴트리톨
- 영어명
- Hexatosylate dipentaerylthritol
- 분자식
- C52H58O19S6
- 분자량
- 1179.4
이름 및 동의어
214144-11-31,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, tetrakis(4-methylbenzenesulfonate) (9CI)Dipentaerythritol hexatosylate[3-(4-methylphenyl)sulfonyloxy-2-[[3-(4-methylphenyl)sulfonyloxy-2,2-bis[(4-methylphenyl)sulfonyloxymethyl]propoxy]methyl]-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonatestarbld0025759SCHEMBL207877183-{3-[(4-methylbenzenesulfonyl)oxy]-2,2-bis({[(4-methylbenzenesulfonyl)oxy]methyl})propoxy}-2,2-bis({[(4-methylbenzenesulfonyl)oxy]methyl})propyl 4-methylbenzene-1-sulfonateCS-0111271헥사토실레이트디펜타에릴트리톨Hexatosylate dipentaerylthritol2,2'-[oxybis(methylene)]bis[2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1,1',3,3'-tetrakis(4-methylbenzenesulfonate1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, 1,1',3,3'-tetrakis(4-methylbenzenesulfonate)
데이터베이스 식별자
- CAS
214144-11-3
물성
구조 계산 물성보충 중
- XLogP
- 8.4
- 극성 표면적
- 320 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 19
- 회전 가능 결합 수
- 28
- 무거운 원자 수
- 77
- 형식 전하
- 0
- 복잡도
- 2,040
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