ethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
기본 정보
- CAS
353479-15-9- 표준 SMILES
CCOC(=O)C1=C(C)NC(=O)NC1c1cc(Cl)c(O)c(OCC)c1- InChIKey
WSSHEALBTWXNOJ-UHFFFAOYSA-N- 분자식
- C16H19ClN2O5
- 평균 분자량
- 354.78 g/mol
이름 및 식별자
- 우선 이름
- ethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
- IUPAC
- ethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
- 영어명
- ethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
- 분자식
- C16H19ClN2O5
- 분자량
- 354.79
이름 및 동의어
6380-31-0AK-968/12164597ethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylateethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylateethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylateOprea1_003127DTXSID10387596STK520840AKOS000353758AKOS022004972AB00106528-01SR-01000502647
이름 더 보기
5-Pyrimidinecarboxylic acid, 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, ethyl ester
SR-01000502647-1353479-15-9
데이터베이스 식별자
- CAS
353479-15-9
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 96.9 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 525
물리화학적 성질
- 끓는 점
- 476.2 · 476.2±45.0 °C(Predicted)
- 밀도
- 1.297 · 1.297±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.54 · 8.54±0.40(Predicted)
관련 반응
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