Octadecanoic acid, hexaester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-1,3-propanediol
기본 정보
- CAS
68785-03-5- 표준 SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(CO)(COCC(COCC(CO)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC- InChIKey
VKKILMLMXIQGGE-UHFFFAOYSA-N- 분자식
- C123H236O16
- 평균 분자량
- 1,971.2 g/mol
- 단동위원소 질량
- 1,969.76534144
이름 및 식별자
- 우선 이름
- Octadecanoic acid, hexaester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-1,3-propanediol
- IUPAC
- [2-(hydroxymethyl)-2-[[2-[[2-(hydroxymethyl)-3-octadecanoyloxy-2-(octadecanoyloxymethyl)propoxy]methyl]-3-octadecanoyloxy-2-(octadecanoyloxymethyl)propoxy]methyl]-3-octadecanoyloxypropyl] octadecanoate
이름 및 동의어
Tripentaerythritol hexastearateDTXSID301015471EINECS 272-289-368785-03-5Octadecanoic acid, hexaester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-1,3-propanediolOctadecanoic acid, hexaester with 2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-1,3-propanediolRefChem:167666DTXCID401473749Octadecanoic acid, hexaester with 2,2-bis3-hydroxy-2,2-bis(hydroxymethyl)propoxymethyl-1,3-propanediol({2,2-Bis[(octadecanoyloxy)methyl]propane-1,3-diyl}bis(oxy)-2-(hydroxymethyl)-2-[(octadecanoyloxy)methyl]propane-3,1-diyl) dioctadecanoateHexastearic acid, hexaester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)propane-1,3-diol
데이터베이스 식별자
- CAS
68785-03-5- PubChem CID
- 111594
- DTXSID
DTXSID301015471- EC Number
- 272-289-3
물성
구조 계산 물성
- XLogP
- 48.7
- 극성 표면적
- 217 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 124
- 무거운 원자 수
- 139
- 형식 전하
- 0
- 복잡도
- 2,290
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationOctadecanoic acid, hexaester with 2,2-bis3-hydroxy-2,2-bis(hydroxymethyl)propoxymethyl-1,3-propanediol: Does not have an individual approval but may be used under an appropriate group standard
화학 및 산업
용도 및 제조
General Manufacturing InformationOctadecanoic acid, hexaester with 2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-1,3-propanediol: ACTIVE
관련 반응
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