기본 정보
- CAS
365413-31-6- 표준 SMILES
CCOC(=O)c1csc(C2CCN(C(=O)OC(C)(C)C)CC2)n1- InChIKey
LBRUPXMVELEXIV-UHFFFAOYSA-N- 분자식
- C16H24N2O4S
- 평균 분자량
- 340.4 g/mol
- 단동위원소 질량
- 340.14567825
이름 및 식별자
- 우선 이름
- Ethyl 2-(1-(tert-butoxycarbonyl)piperidin-4-yl)thiazole-4-carboxylate
- IUPAC
- ethyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate
- 영어명
- tert-Butyl 4-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]tetrahydro-1(2H)-pyridinecarboxylate
- 분자식
- C16H24N2O4S
- 분자량
- 340.44
이름 및 동의어
365413-31-6Ethyl 2-(1-(tert-butoxycarbonyl)piperidin-4-yl)thiazole-4-carboxylateTERT-BUTYL 4-[4-(ETHOXYCARBONYL)-1,3-THIAZOL-2-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATEMFCD06659069tert-Butyl 4-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate1-BOC-4-(4-ETHOXYCARBONYL-THIAZOL-2-YL)-PIPERIDINEethyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazole-4-carboxylatetert-Butyl 4-(4-ethoxycarbonylthiazol-2-yl)piperidine-1-carboxylateSCHEMBL419527ethyl 2-(1-BOC-piperidin-4-yl)thiazole-4-carboxylateDTXSID30383752LBRUPXMVELEXIV-UHFFFAOYSA-N
이름 더 보기
BOC-4-[4-(ETHOXYCARBONYL)-1,3-THIAZOL-2-YL]PIPERIDINE4-[4-(Ethoxycarbonyl)-1,3-thiazol-2-yl]piperidine,N-BOCprotected95%4-[4-(Ethoxycarbonyl)-1,3-thiazol-2-yl]piperidine, N-BOC protected 95%tert-Butyl-4-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]-piperizine-1-carboxylate
4-[4-(Ethoxycarbonyl)-1,3-thiazol-2-yl]piperidine, N-BOC protectedAKOS015838245SY237639CS-0200004F302606Ethyl 2-(1-Boc-4-piperidinyl)thiazole-4-carboxylateethyl 2-(1-tert-butoxycarbonyl-4-piperidyl)thiazole-4-carboxylateEthyl2-(1-(tert-butoxycarbonyl)piperidin-4-yl)thiazole-4-carboxylate
데이터베이스 식별자
- CAS
365413-31-6- PubChem CID
- 2795532
- DTXSID
DTXSID30383752
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 97 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 430
물리화학적 성질
- 녹는점
- 71 °C · 71 °C
- 끓는 점
- 444.9 · 444.9±35.0 °C(Predicted)
- 밀도
- 1.19 · 1.190±0.06 g/cm3(Predicted)
- 저장 조건
- Refrigerated.
- 산도 계수 (pKa)
- 0.75 · 0.75±0.10(Predicted)
- 물리적 상태
- 가루
- 색상
- 회백색
안전 및 규제
안전 데이터
- HS 번호
- 2933399990
- risk_code
- 22-36/37/38
- hazard_code
- Xn
- safety_code
- 22-26-36/37/39
- 위험 참고 사항
- Harmful
화학 및 산업
공급사23 곳
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Aladdin Scientific[email protected]
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