기본 정보
- CAS
13206-31-0- 표준 SMILES
CC(C)C1NC(C(=O)O)C(C)(C)S1- InChIKey
JLLDUMMFTKVTLS-UHFFFAOYSA-N- 분자식
- C9H17NO2S
- 평균 분자량
- 203.3 g/mol
- 단동위원소 질량
- 203.09799978
이름 및 식별자
- 우선 이름
- 2-Isopropyl-5,5-dimethylthiazolidine-4-carboxylic acid
- IUPAC
- 5,5-dimethyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylic acid
- 현지명
- 2-이소프로필-5,5-디메틸티아졸리딘-4-카르복실산
- 영어명
- 2-isopropyl-5,5-dimethylthiazolidine-4-carboxylic acid
- 분자식
- C9H17NO2S
- 분자량
- 203.3
이름 및 동의어
13206-31-02-Isopropyl-5,5-dimethylthiazolidine-4-carboxylic acidJZ7Y3897YCEINECS 236-174-1NSC-1207505,5-Dimethyl-2-(1-methylethyl)-4-thiazolidinecarboxylic acidNSC 1207504-THIAZOLIDINECARBOXYLIC ACID, 2-ISOPROPYL-5,5-DIMETHYL-4-Thiazolidinecarboxylic acid, 5,5-dimethyl-2-(1-methylethyl)-RefChem:87730236-174-15,5-dimethyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylic acid
이름 더 보기
2-이소프로필-5,5-디메틸티아졸리딘-4-카르복실산5,5-dimethyl-2-isopropylthiazolidine-4-carboxylic acid2-Isopropyl-5,5’-dimethylthiazolidine-4-carboxyic acid
JLLDUMMFTKVTLS-UHFFFAOYSA-NNSC120750UNII-JZ7Y3897YCSCHEMBL7552953DTXSID709275184-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-(1-methylethyl)-5,5-Dimethyl-2-(propan-2-yl)-1,3-thiazolidine-4-carboxylic acidDS-005541
데이터베이스 식별자
- CAS
13206-31-0- PubChem CID
- 98398
- DTXSID
DTXSID70927518- UNII
- JZ7Y3897YC
- EC Number
- 236-174-1
- Nikkaji
- J213.749F
물성
구조 계산 물성
- XLogP
- -0.3
- 극성 표면적
- 74.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 216
화학 및 산업
응용 분야
용도5,5-Dimethyl-2-(1-Methylethyl)-4-Thiazolidinecarboxylic Acid is a penicillamine analogue which is useful in the treatment of arthritis kidney stones and metal poisoning.
공급사7 곳
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