기본 정보
- CAS
63123-21-7- 표준 SMILES
CCOC(=O)c1c(C)nc2nc(SC)[nH]n2c1=O- InChIKey
QOBVERSXZLZHLD-UHFFFAOYSA-N- 분자식
- C10H12N4O3S
- 평균 분자량
- 268.29 g/mol
- 단동위원소 질량
- 268.06301143
이름 및 식별자
- 우선 이름
- Ethyl 7-hydroxy-5-methyl-2-(methylthio)(1,2,4)triazolo(1,5-a)pyrimidine-6-carboxylate
- IUPAC
- ethyl 5-methyl-2-methylsulfanyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
- 영어명
- ethyl 7-hydroxy-5-methyl-2(methylthio)-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylate
- 분자식
- C10H12N4O3S
- 분자량
- 268.29
이름 및 동의어
63123-21-7QT5GI4Q9PEEINECS 263-870-2[1,2,4]Triazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-hydroxy-5-methyl-2-(methylthio)-, ethyl esterDTXSID5069677(1,2,4)Triazolo(1,5-a)pyrimidine-6-carboxylic acid, 7-hydroxy-5-methyl-2-(methylthio)-, ethyl esterEthyl 7-hydroxy-5-methyl-2(methylthio)-1,2,4-triazolo(1,5-a)pyrimidine-6-carboxylateEthyl 7-hydroxy-5-methyl-2(methylthio)-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylateEthyl 7-hydroxy-5-methyl-2-(methylthio)(1,2,4)triazolo(1,5-a)pyrimidine-6-carboxylateEthyl 7-hydroxy-5-methyl-2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylateRefChem:596023DTXCID3043655
이름 더 보기
7-Hydroxy-5-methyl-2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester
263-870-2Ethyl 5-methyl-2-(methylthio)-7-oxo-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylateethyl 7-hydroxy-5-methyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylateUNII-QT5GI4Q9PELNGKJTVVGYFYMY-UHFFFAOYSA-NDB-297585
물성
구조 계산 물성
- XLogP
- 0.9
- 극성 표면적
- 109 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 509
물리화학적 성질
- EPA
- 1 · [1,2,4]Triazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-hydroxy-5-methyl-2-(methylthio)-, ethyl ester (63123-21-7)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information[1,2,4]Triazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-hydroxy-5-methyl-2-(methylthio)-, ethyl ester: INACTIVE
관련 반응
0건
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