기본 정보
- CAS
6047-47-8- 표준 SMILES
CC(=O)OCC1OC(OC(=N)C(Cl)(Cl)Cl)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O- InChIKey
IBUZGVQIKARDAF-UHFFFAOYSA-N- 분자식
- C16H20Cl3NO10
- 평균 분자량
- 492.7 g/mol
- 단동위원소 질량
- 491.01527888
이름 및 식별자
- 우선 이름
- [3,4,5-Triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate
- IUPAC
- [3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate
이름 및 동의어
2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl trichloroacetimidate158250-57-86047-47-8Tetra-O-acetyl-alpha-D-glucose trichloroacetimidateC16H20Cl3NO10[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate[3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate2,3,4,6-Tetra-O-acetyl-a-D-mannopyranosyl trichloroacetimidateD-Glucopyranose, 2,3,4,6-tetraacetate 1-(2,2,2-trichloroethanimidate)SCHEMBL10062339DTXSID009758802,3,4,6-Tetra-O-acetyl-1-O-trichloroacetimidoyl-D-mannopyranose
이름 더 보기
MT014422,3,4,6-Tetra-O-acetyl-1-O-(2,2,2-trichloroethanimidoyl)hexopyranose2,3,4,6-Tetra-O-acetyl-a-D-galactopyranosyl 2,2,2-trichloroacetimidate2,3,4,6-Tetra-O-acetyl-b-D-glucopyranosyl 2,2,2-trichloroacetimidatea-D-Glucopyranose,2,3,4,6-tetraacetate 1-(2,2,2-trichloroethanimidate)[3,4,5-triacetoxy-6-(2,2,2-trichloroethanimidoyl)oxy-tetrahydropyran-2-yl]methyl acetate[3,4,5-triacetyloxy-6-[2,2,2-tris(chloranyl)ethanimidoyloxy]oxan-2-yl]methyl ethanoate
데이터베이스 식별자
- CAS
6047-47-8- PubChem CID
- 5201201
- DTXSID
DTXSID00975880
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 148 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 695
관련 반응
15건
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