Basic information
- CAS
1227577-13-0- Standard SMILES
Cc1cc(=O)cc(F)[nH]1- InChIKey
LADSKNVNWBCACR-UHFFFAOYSA-N- Molecular formula
- C6H6FNO
- Average molar mass
- 127.12 g/mol
- Monoisotopic mass
- 127.04334198
Names & identifiers
- Preferred name
- 2-Fluoro-6-methylpyridin-4-ol
- IUPAC
- 2-fluoro-6-methyl-1H-pyridin-4-one
- English name
- 2-fluoro-6-Methylpyridin-4-ol
- Molecular formula
- C6H6FNO
- Molecular weight
- 127.12
Names & synonyms
1227577-13-02-fluoro-6-methylpyridin-4-ol2-fluoro-6-methyl-1H-pyridin-4-one2-Fluoro-4-hydroxy-6-methylpyridine2-Fluoro-6-methylpyridin-4(1H)-oneDTXSID907044094-Hydroxy-2-fluoro-6-methylpyridineCS-37985DB-0620874-Pyridinol, 2-fluoro-6-methyl-
Database identifiers
- CAS
1227577-13-0- PubChem CID
- 53485196
- DTXSID
DTXSID90704409
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Boiling point
- 367.5 · 367.5±37.0 °C(Predicted)
- Density
- 1.251 · 1.251±0.06 g/cm3(Predicted)
- pka
- 8.48 · 8.48±0.10(Predicted)
Chemistry & industry
Suppliers4 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]
济南鑫宏泰化学有限公司13000000000 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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