1-(6-Aminopurin-9-yl)-3-prop-2-enoxypropan-2-ol
Basic information
- CAS
89760-74-7- Standard SMILES
C=CCOCC(O)Cn1cnc2c(N)ncnc21- InChIKey
ZVZZSRXLVAABGA-UHFFFAOYSA-N- Molecular formula
- C11H15N5O2
- Average molar mass
- 249.27 g/mol
- Monoisotopic mass
- 249.12257474
Names & identifiers
- Preferred name
- 1-(6-Aminopurin-9-yl)-3-prop-2-enoxypropan-2-ol
- IUPAC
- 1-(6-aminopurin-9-yl)-3-prop-2-enoxypropan-2-ol
Names & synonyms
89760-74-71-(6-aminopurin-9-yl)-3-prop-2-enoxypropan-2-olNSC361755DTXSID60320599NSC-361755DS-0094559H-purine-9-ethanol,6-amino-a-[(2-propen-1-yloxy)methyl]-1-(6-Amino-9H-purin-9-yl)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Database identifiers
- CAS
89760-74-7- PubChem CID
- 338600
- DTXSID
DTXSID60320599
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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