2,6-Dimethyl-1H-purine
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Basic information
- CAS
5943-89-5- Standard SMILES
Cc1nc(C)c2nc[nH]c2n1- InChIKey
LCNSRLOKWJJBSO-UHFFFAOYSA-N- Molecular formula
- C7H8N4
- Average molar mass
- 148.17 g/mol
Names & identifiers
- Preferred name
- 2,6-Dimethyl-1H-purine
- IUPAC
- 2,6-dimethyl-7H-purine
- English name
- 1H-Purine, 2,6-dimethyl- (9CI)
- Molecular formula
- C7H8N4
- Molecular weight
- 148.17
Names & synonyms
2,6-Dimethyl-1H-purine5943-89-51H-Purine, 2,6-dimethyl-SCHEMBL2965047SCHEMBL7019371SCHEMBL20611894SCHEMBL29366073AKOS006374428DB-3229849H-Purine, 2,6-dimethyl-1H-Purine, 2,6-dimethyl- (9CI)
Database identifiers
- CAS
5943-89-5- Nikkaji
- J1.928.201E
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
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Compound notes
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