4-(6-Ethoxypurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
Basic information
- CAS
64332-72-5- Standard SMILES
CCOc1ncnc2c1ncn2C1COC(CO)C1O- InChIKey
UHNSQFYLNBCQCT-UHFFFAOYSA-N- Molecular formula
- C12H16N4O4
- Average molar mass
- 280.28 g/mol
- Monoisotopic mass
- 280.117155
Names & identifiers
- Preferred name
- 4-(6-Ethoxypurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
- IUPAC
- 4-(6-ethoxypurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
Names & synonyms
64332-72-54-(6-ethoxypurin-9-yl)-2-(hydroxymethyl)oxolan-3-olNSC253940DTXSID00330410NSC-2539401,4-Anhydro-2-deoxy-2-(6-ethoxy-9H-purin-9-yl)pentitol
Database identifiers
- CAS
64332-72-5- PubChem CID
- 429340
- DTXSID
DTXSID00330410
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 335
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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