N,N,9-Trimethyl-9H-purin-6-amine
Basic information
- CAS
3013-82-9- Standard SMILES
CN(C)c1ncnc2c1ncn2C- InChIKey
GQKLJZOIXKFFQC-UHFFFAOYSA-N- Molecular formula
- C8H11N5
- Average molar mass
- 177.21 g/mol
- Monoisotopic mass
- 177.10144537
Names & identifiers
- Preferred name
- N,N,9-Trimethyl-9H-purin-6-amine
- IUPAC
- N,N,9-trimethylpurin-6-amine
Names & synonyms
3013-82-9N,N,9-Trimethyl-9H-purin-6-amineDimethyl-(9-methyl-9H-purin-6-yl)-amineNSC49499H-Purin-6-amine, N,N,9-trimethyl-CHEMBL7977n6,n6,n9-trimethyl-adenineSCHEMBL9604572DTXSID30277925GQKLJZOIXKFFQC-UHFFFAOYSA-NNSC-4949AKOS015905020
Show more names
N,N,9-Trimethyl-9H-purin-6-amine #DS-0020419H-PURIN-6-AMINE,N,N,9-TRIMETHYL-
Database identifiers
- CAS
3013-82-9- PubChem CID
- 221105
- DTXSID
DTXSID30277925- ChEMBL
CHEMBL7977- Nikkaji
- J611.441E
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 46.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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