6,7-Dimethylpteridine
Basic information
- CAS
704-61-0- Standard SMILES
Cc1nc2cncnc2nc1C- InChIKey
HBHGSVQQEYTFFZ-UHFFFAOYSA-N- Molecular formula
- C8H8N4
- Average molar mass
- 160.18 g/mol
- Monoisotopic mass
- 160.07489627
Names & identifiers
- Preferred name
- 6,7-Dimethylpteridine
- IUPAC
- 6,7-dimethylpteridine
- English name
- 6,7-Dimethylpteridine
- Molecular formula
- C8H8N4
- Molecular weight
- 160.18
Names & synonyms
6,7-DimethylpteridinePteridine, 6,7-dimethyl-704-61-0DTXSID70344160RefChem:306257DTXCID80295235HBHGSVQQEYTFFZ-UHFFFAOYSA-NSCHEMBL2490862SCHEMBL30290978AKOS024321347AC-907/34119064
Database identifiers
- CAS
704-61-0- PubChem CID
- 594789
- DTXSID
DTXSID70344160- Nikkaji
- J113.008K
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- Boiling point
- 276.07 °C · 276.07°C (rough estimate)
- Density
- 1.2583 · 1.2583 (rough estimate)
- refractive index
- 1.5872 · 1.5872 (estimate)
- Water Solubility
- 55.56 g/L · 55.56g/L(20 ºC)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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