Basic information
- CAS
16499-46-0- Standard SMILES
Cc1ncc2cc(F)ccc2n1- InChIKey
WVCVHKMIMFZFAP-UHFFFAOYSA-N- Molecular formula
- C9H7FN2
- Average molar mass
- 162.16 g/mol
- Monoisotopic mass
- 162.05932639
Names & identifiers
- Preferred name
- 6-Fluoro-2-methylquinazoline
- IUPAC
- 6-fluoro-2-methylquinazoline
- English name
- 6-Fluoro-2-methylquinazoline
- Molecular formula
- C9H7FN2
- Molecular weight
- 162.16
Names & synonyms
6-fluoro-2-methylquinazoline16499-46-0SCHEMBL13106403SCHEMBL31391518DTXSID801308902Quinazoline, 6-fluoro-2-methyl-
Database identifiers
- CAS
16499-46-0- PubChem CID
- 57674875
- DTXSID
DTXSID801308902
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 189.1 · 189.1±22.0 °C(Predicted)
- Density
- 1.242 · 1.242±0.06 g/cm3(Predicted)
- pka
- 4.13 · 4.13±0.50(Predicted)
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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