기본 정보
- 표준 SMILES
CC(C)(C/C=C/C(=O)O)NC(=O)OC(C)(C)C- InChIKey
NRPOEGFAIJAQIE-VOTSOKGWSA-N- 분자식
- C12H21NO4
- 평균 분자량
- 243.3 g/mol
- 단동위원소 질량
- 243.14705815
이름 및 식별자
- 우선 이름
- (2E)-5-(tert-Butyloxycarbonylamino)-5-methylhex-2-enoic acid
- IUPAC
- (E)-5-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-2-enoic acid
이름 및 동의어
181646-42-4(2E)-5-(tert-Butyloxycarbonylamino)-5-methylhex-2-enoic acid(2E)-5-{[(tert-butoxy)carbonyl]amino}-5-methylhex-2-enoic acid(E)-5-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-2-enoic Acid2-Hexenoic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-5-methyl-,(2E)-(2E)-5-[[(1,1-Dimethylethoxy)carbonyl]amino]-5-methyl-2-hexenoic Acid; (E)- 5-[[(1,1-Dimethylethoxy)carbonyl]amino]-5-methyl-2-hexenoic AcidSCHEMBL1401112NRPOEGFAIJAQIE-VOTSOKGWSA-NDB-192885EN300-23404861(2E)-5-tertButoxycarbonylamino-5-methylhex-2-enoic acid(2E)-5tert-Butoxycarbonylamino-5-methylhex-2enoic acid
이름 더 보기
(2E)-5-(tertbutoxycarbonylamino)-5-methylhex-2-enoic acid(2E)-5-tert-Butoxycarbonylamino-5-methylhex-2-enoic acid(2E)-5(tert.-butoxycarbonylamino)-5-methylhex-2-enoic acid(2E)-5-(tert-butoxycarbonylamino)-5-methylhex-2-enoic acid(2E)-5-(tert-butyloxycarbonylamino)-5-methyl-2-hexenoic acid(2E)-5-(tert-Butyloxycarbonylamino)-5-methylhex-2enoic acid(2E)-5-(tert-butyoxycarbonylamino)-5-methylhex-2-enoic acid(2E)-5-(tert.-butoxycarbonylamino)-5-methylhex-2-enoic acid
데이터베이스 식별자
- PubChem CID
- 10847814
- Nikkaji
- J1.549.434D
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 75.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 313
관련 반응
108건
화합물 노트
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