기본 정보
- CAS
103968-87-2- 표준 SMILES
CN(C)S(=O)(=O)c1cc2c(c(Cl)c1Cl)OC(C(=O)O)C2- InChIKey
ZTFUDCAAHOVUPH-UHFFFAOYSA-N- 분자식
- C11H11Cl2NO5S
- 평균 분자량
- 340.2 g/mol
- 단동위원소 질량
- 338.973499
이름 및 식별자
- 우선 이름
- 6,7-Dichloro-5-((dimethylamino)sulfonyl)-2,3-dihydro-2-benzofurancarboxylic acid
- IUPAC
- 6,7-dichloro-5-(dimethylsulfamoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid
- 영어명
- S 8666
- 분자량
- 0
이름 및 동의어
103968-87-2S 8666S-86666,7-dichloro-5-(N,N-dimethylsulfamoyl)-2,3-dihydrobenzofuran-2-carboxylic acid2-Benzofurancarboxylic acid, 6,7-dichloro-5-((dimethylamino)sulfonyl)-2,3-dihydro-RefChem:9136736,7-Dichloro-5-((dimethylamino)sulfonyl)-2,3-dihydro-2-benzofurancarboxylic acid6,7-dichloro-5-(dimethylsulfamoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid5-dimethylsulfamoyl-6,7-dichloro-2,3-dihydrobenzofuran-2-carboxylic acid108940-99-4S-8666 (-)(S)-2,3-Dihydro-6,7-dichloro-5-((dimethylamino)sulfonyl)-2-benzofurancarboxylic acid
이름 더 보기
(S)-(-)-DBCA(R)-(+)-DBCA[R,(+)]-S-8666[S,(-)]-S-86666,7-Dichloro-5-[(dimethylamino)sulfonyl]-2,3-dihydro-2-benzofurancarboxylic acid[S,(-)]-6,7-Dichloro-5-[(dimethylamino)sulfonyl]-2,3-dihydrobenzofuran-2α-carboxylic acid[R,(+)]-6,7-Dichloro-5-[(dimethylamino)sulfonyl]-2,3-dihydrobenzofuran-2β-carboxylic acid
2,3-Dihydro-6,7-dichloro-5-((dimethylamino)sulfonyl)-2-benzofurancarboxylic acid2-Benzofurancarboxylic acid, 2,3-dihydro-6,7-dichloro-5-((dimethylamino)sulfonyl)-, (S)-2-Benzofurancarboxylicacid, 6,7-dichloro-5-[(dimethylamino)sulfonyl]-2,3-dihydro-orb1695347SCHEMBL9512820CHEMBL4763396DTXSID00908698ZTFUDCAAHOVUPH-UHFFFAOYSA-N
데이터베이스 식별자
- CAS
103968-87-2、108940-99-4- PubChem CID
- 59802
- DTXSID
DTXSID00908698- ChEMBL
CHEMBL4763396- Nikkaji
- J126.205J
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 92.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 492
화학 및 산업
공급사5 곳
上海德轩医药科技有限公司[email protected] · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
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