기본 정보
- CAS
105219-73-6- 표준 SMILES
CCOC(=O)Cc1nc2sc(C)c(C)c2c(=O)[nH]1- InChIKey
CJVDOLYFRBLIHP-UHFFFAOYSA-N- 분자식
- C12H14N2O3S
- 평균 분자량
- 266.32 g/mol
- 단동위원소 질량
- 266.07251331
이름 및 식별자
- 우선 이름
- Ethyl 2-(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)acetate
- IUPAC
- ethyl 2-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)acetate
- 현지명
- (5,6-DIMETHYL-4-OXO-3,4-DIHYDRO-THIENO[2,3-D]PYRIMIDIN-2-YL)-아세트산에틸에스테르
- 영어명
- (5,6-DIMETHYL-4-OXO-3,4-DIHYDRO-THIENO[2,3-D]PYRIMIDIN-2-YL)-ACETIC ACID ETHYL ESTER
- 분자식
- C12H14N2O3S
- 분자량
- 266.32
이름 및 동의어
105219-73-6Ethyl 2-(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)acetateethyl 2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-2-yl}acetate(5,6-Dimethyl-4-oxo-3,4-dihydro-thieno[2,3-d]pyrimidin-2-yl)-acetic acid ethyl esterethyl 2-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)acetateethyl 2-{5,6-dimethyl-4-oxo-1H,4H-thieno[2,3-d]pyrimidin-2-yl}acetateETHYL 2-(5,6-DIMETHYL-4-OXO-3H,4H-THIENO[2,3-D]PYRIMIDIN-2-YL)ACETATEDTXSID30368448MFCD04621455SBB078078AKOS005135757SY133905
이름 더 보기
(5,6-DIMETHYL-4-OXO-3,4-DIHYDRO-THIENO[2,3-D]PYRIMIDIN-2-YL)-아세트산에틸에스테르Ethyl 1,4-dihydro-5,6-dimethyl-4-oxothieno2,3-dpyrimidin-2-acetateEthyl 1,4-dihydro-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidine-2-acetate1,4-Dihydro-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-acetic acid ethyl esterThieno[2,3-d]pyriMidine-2-aceticacid, 1,4-dihydro-5,6-diMethyl-4-oxo-, ethyl ester
CS-0220383EN300-06521G58760F643120Z55995619Ethyl (5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)acetateethyl 2-(5,6-dimethyl-4-oxo-3-hydrothiopheno[2,3-d]pyrimidin-2-yl)acetateEthyl 5,6-Dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-2-acetate
데이터베이스 식별자
- CAS
105219-73-6- PubChem CID
- 2393462
- DTXSID
DTXSID30368448- EC Number
- 138-906-4
물성
구조 계산 물성
- XLogP
- 1.9
- 극성 표면적
- 96 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 397
물리화학적 성질
- 밀도
- 1.39 · 1.39±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 10.87 · 10.87±0.20(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)
화학 및 산업
공급사5 곳
赛纳斯特化学（欢迎点击联系）021-60343070
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
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