Basic information
- CAS
131077-98-0- Standard SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(F)F)[C@@H](O)[C@H]1O- InChIKey
YQLJSFYLQCBEKY-LKCKTBJASA-N- Molecular formula
- C10H11F2N5O3
- Average molar mass
- 287.22 g/mol
- Monoisotopic mass
- 287.08299555
Overview
structure given in first source
Names & identifiers
- Preferred name
- 5'-Deoxy-5'-difluoroadenosine
- IUPAC
- (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluoromethyl)oxolane-3,4-diol
- English name
- (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluoromethyl)oxolane-3,4-diol
- Molecular formula
- C10H11F2N5O3
- Molecular weight
- 0
Names & synonyms
131077-98-05-Ddfa5'-deoxy-5',5'-difluoroadenosine5',5'-difluoro-5'-deoxyadenosine5'-Deoxy-5'-difluoroadenosineRefChem:100780Adenosine, 5'-deoxy-5',5'-difluoro-(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluoromethyl)oxolane-3,4-diol(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-(difluoromethyl)tetrahydrofuran-3,4-diolSCHEMBL8990546DTXSID409270655'-Deoxy-5',5'-difluoro-Adenosine
Show more names
9-(5-Deoxy-5,5-difluoropentofuranosyl)-9H-purin-6-amine
Database identifiers
- CAS
131077-98-0- PubChem CID
- 3083166
- DTXSID
DTXSID40927065- Nikkaji
- J374.092G
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 366
Chemistry & industry
Suppliers2 total
杭州六可生物科技有限公司+86-571-86912261 19975279805 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
1 records
Compound notes
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