1-(2-Deoxypentofuranosyl)pyridin-4(1h)-one
Basic information
- CAS
53667-32-6- Standard SMILES
O=c1ccn(C2CC(O)C(CO)O2)cc1- InChIKey
PMZDNLISFGRAQB-UHFFFAOYSA-N- Molecular formula
- C10H13NO4
- Average molar mass
- 211.21 g/mol
- Monoisotopic mass
- 211.0844579
Names & identifiers
- Preferred name
- 1-(2-Deoxypentofuranosyl)pyridin-4(1h)-one
- IUPAC
- 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyridin-4-one
Names & synonyms
53667-32-61-(2-deoxypentofuranosyl)pyridin-4(1h)-oneNSC144744DTXSID40968438NSC-144744
Database identifiers
- CAS
53667-32-6- PubChem CID
- 286491
- DTXSID
DTXSID40968438
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 297
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Compound notes
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