Basic information
- CAS
115249-86-0- Standard SMILES
O=c1[nH]c(=O)n(C2CC(F)C(CO)O2)cc1Br- InChIKey
BWBBMKFAGMRESB-UHFFFAOYSA-N- Molecular formula
- C9H10BrFN2O4
- Average molar mass
- 309.09 g/mol
- Monoisotopic mass
- 307.9808
Overview
inhibitor of HIV; structure given in first source
Names & identifiers
- Preferred name
- 3'-Fluoro-2',3'-dideoxy-5-bromouridine
- IUPAC
- 5-bromo-1-[4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
- English name
- 3'-fluoro-2',3'-dideoxy-5-bromouridine
- Molecular formula
- C9H10BrFN2O4
- Molecular weight
- 309.09
Names & synonyms
Fddbrurd3'-Fluoro-2',3'-dideoxy-5-bromouridineRefChem:90390115249-86-05-Bromo-3'-fluoro-2',3'-dideoxyuridine2',3'-Dideoxy-3'-fluoro-5-bromouridine5-bromo-2',3'-dideoxy-3'-fluorouridineUridine, 5-bromo-2',3'-dideoxy-3'-fluoro-
Database identifiers
- CAS
115249-86-0- PubChem CID
- 86145
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- Melting point
- 154 · 154-155 °C (decomp)(Solv: methanol (67-56-1); ethyl ether (60-29-7))
- Density
- 1.86 · 1.86±0.1 g/cm3(Predicted)
- pka
- 7.73 · 7.73±0.10(Predicted)
Chemistry & industry
Suppliers2 total
杭州六可生物科技有限公司+86-571-86912261 19975279805 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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