기본 정보
- CAS
65133-66-6- 표준 SMILES
C=C(C)C(=O)OCCOCCOc1ccc(C(C)(C)c2ccc(OCCOC(=O)C(=C)C)cc2)cc1- InChIKey
NGFFKUHICVFZTR-UHFFFAOYSA-N- 분자식
- C29H36O7
- 평균 분자량
- 496.6 g/mol
- 단동위원소 질량
- 496.24610348
이름 및 식별자
- 우선 이름
- 2-Propenoic acid, 2-methyl-, 2-(4-(1-methyl-1-(4-(2-(2-((2-methyl-1-oxo-2-propen-1-yl)oxy)ethoxy)ethoxy)phenyl)ethyl)phenoxy)ethyl ester
- IUPAC
- 2-[2-[4-[2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]phenyl]propan-2-yl]phenoxy]ethoxy]ethyl 2-methylprop-2-enoate
이름 및 동의어
2-Propenoic acid, 2-methyl-, 2-[4-[1-methyl-1-[4-[2-[2-[(2-methyl-1-oxo-2-propenyl)oxy]ethoxy]ethoxy]phenyl]ethyl]phenoxy]ethyl ester2-Propenoic acid, 2-methyl-, 2-(4-(1-methyl-1-(4-(2-(2-((2-methyl-1-oxo-2-propen-1-yl)oxy)ethoxy)ethoxy)phenyl)ethyl)phenoxy)ethyl ester2-Propenoic acid, 2-methyl-, 2-(4-(1-methyl-1-(4-(2-(2-((2-methyl-1-oxo-2-propenyl)oxy)ethoxy)ethoxy)phenyl)ethyl)phenoxy)ethyl ester2-Propenoic acid, 2-methyl-, 2-[4-[1-methyl-1-[4-[2-[2-[(2-methyl-1-oxo-2-propen-1-yl)oxy]ethoxy]ethoxy]phenyl]ethyl]phenoxy]ethyl esterRefChem:47953865133-66-6DTXSID9070244SCHEMBL19770676NGFFKUHICVFZTR-UHFFFAOYSA-N2-(4-{2-[4-(2-{2-[(2-Methylprop-2-enoyl)oxy]ethoxy}ethoxy)phenyl]propan-2-yl}phenoxy)ethyl 2-methylprop-2-enoate
데이터베이스 식별자
- CAS
65133-66-6- PubChem CID
- 103247
- DTXSID
DTXSID9070244- Nikkaji
- J453.312G
물성
구조 계산 물성
- XLogP
- 6.2
- 극성 표면적
- 80.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 17
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 713
화학 및 산업
용도 및 제조
General Manufacturing Information2-Propenoic acid, 2-methyl-, 2-[4-[1-methyl-1-[4-[2-[2-[(2-methyl-1-oxo-2-propen-1-yl)oxy]ethoxy]ethoxy]phenyl]ethyl]phenoxy]ethyl ester: INACTIVE
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