6-(trimethoxymethyl)-7H-purine
Basic information
- CAS
92985-80-3- Standard SMILES
COC(OC)(OC)c1ncnc2nc[nH]c12- InChIKey
KSZYGRIMJDVXGQ-UHFFFAOYSA-N- Molecular formula
- C9H12N4O3
- Average molar mass
- 224.22 g/mol
- Monoisotopic mass
- 224.09094026
Names & identifiers
- Preferred name
- 6-(trimethoxymethyl)-7H-purine
- IUPAC
- 6-(trimethoxymethyl)-7H-purine
Names & synonyms
92985-80-36-(trimethoxymethyl)-7H-purine6-(trimethoxymethyl)-5H-purineDTXSID80421557NSC526433NSC-526433DS-005818
Database identifiers
- CAS
92985-80-3- PubChem CID
- 5969641
- DTXSID
DTXSID80421557
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 82.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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