기본 정보
- 표준 SMILES
CCOC(=O)c1cnc(CBr)s1- InChIKey
QSASMAYDRANGTN-UHFFFAOYSA-N- 분자식
- C7H8BrNO2S
- 평균 분자량
- 250.12 g/mol
이름 및 식별자
- 우선 이름
- Ethyl 2-(bromomethyl)thiazole-5-carboxylate
- IUPAC
- ethyl 2-(bromomethyl)-1,3-thiazole-5-carboxylate
이름 및 동의어
Ethyl 2-(bromomethyl)thiazole-5-carboxylate173089-24-2ethyl 2-(bromomethyl)-1,3-thiazole-5-carboxylate2-bromomethyl-5-thiazolecarboxylic acid ethyl esterMFCD129138725-Thiazolecarboxylic acid, 2-(bromomethyl)-, ethyl ester2-(bromomethyl)-5-thiazolecarboxylic acid ethyl esterSCHEMBL1646493QSASMAYDRANGTN-UHFFFAOYSA-NAKOS024262477AS-47352Ethyl 2-bromomethyl-5-thiazolecarboxylate
이름 더 보기
SY123745Ethyl2-(bromomethyl)thiazole-5-carboxylateDB-319337CS-0037699F134032-Bromomethyl-5-thiazolecarboxylic acid, ethyl esterEthyl 2-(Bromomethyl)Thiazole-5-Carboxylate(WX618437)
데이터베이스 식별자
- PubChem CID
- 21840919
- Nikkaji
- J3.126.454E
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 67.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 167
관련 반응
8건
화합물 노트
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