기본 정보
- 표준 SMILES
CCOC(=O)C=C(C)CP(=O)(OCC)OCC- InChIKey
OQKGPUSERILONW-UHFFFAOYSA-N- 분자식
- C11H21O5P
- 평균 분자량
- 264.25 g/mol
- 단동위원소 질량
- 264.11266076
이름 및 식별자
- 우선 이름
- Ethyl 4-(diethoxyphosphoryl)-3-methylcrotonate
- IUPAC
- ethyl 4-diethoxyphosphoryl-3-methylbut-2-enoate
이름 및 동의어
C11H21O5Pdiethyl 3-ethoxycarbonyl-2-methyl-2-propenylphosphonateethyl 4-(diethoxyphosphoryl)-3-methylcrotonateSCHEMBL711893Triethyl 3-methyl-4-phosphono-2-butenoate, mixture of cis and transOQKGPUSERILONW-UHFFFAOYSA-NMFCD08445507AKOS030241299DA-05986ethyl 4-diethoxyphosphinyl-3-methyl-2-butenoateethyl 4(diethoxyphosphoryl)-3-methyl-but-2-enoateethyl 4-diethoxyphosphoryl-3-methyl-but-2-enoate
이름 더 보기
ethyl 4-(diethoxyphosphoryl)-3-methyl-but-2-enoatediethyl 3-ethoxycarbonyl-2-methylprop-2-enyl-phosphonatediethyl 3-ethoxycarbonyl-2-methylprop-2-enylphosphonatediethyl 3-ethoxycarbonyl-2-methyl-prop-2-enyl-phosphonate4-(diethoxy-phosphinyl)-3-methyl-but-2-enoic acid ethyl ester4-(diethoxy-phosphoryl)-3-methyl-but-2-enoic acid ethyl ester
데이터베이스 식별자
- PubChem CID
- 2773818
물성
구조 계산 물성
- XLogP
- 1.3
- 극성 표면적
- 61.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 301
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관련 반응
20건
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