Purine, 6-chloro-9-(d-1-methylphenethyl)-
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Basic information
- CAS
73972-53-9- Standard SMILES
C[C@H](Cc1ccccc1)n1cnc2c(Cl)ncnc21- InChIKey
AWGWIELXCODGMV-SNVBAGLBSA-N- Molecular formula
- C14H13ClN4
- Average molar mass
- 272.73 g/mol
- Monoisotopic mass
- 272.0828741
Names & identifiers
- Preferred name
- Purine, 6-chloro-9-(d-1-methylphenethyl)-
- IUPAC
- 6-chloro-9-[(2R)-1-phenylpropan-2-yl]purine
- English name
- 6-Chloro-9-[(R)-α-methylphenethyl]-9H-purine
- Molecular formula
- C14H13ClN4
- Molecular weight
- 272.73
Names & synonyms
Purine, 6-chloro-9-(d-1-methylphenethyl)-73972-53-99-(d-1-Methyl-2-phenylethyl)-6-chloropurineDTXSID50224714RefChem:375835DTXCID801472056-Chloro-9-[(R)-alpha-methylphenethyl]-9H-purine6-chloro-9-[(2R)-1-phenylpropan-2-yl]-9H-purine6-Chloro-9-[(R)-α-methylphenethyl]-9H-purine9H-Purine, 6-chloro-9-(1-methyl-2-phenylethyl)-, (R)- (9CI)
Database identifiers
- CAS
73972-53-9- PubChem CID
- 3045242
- DTXSID
DTXSID50224714- Nikkaji
- J113.495G
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
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Compound notes
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