Basic information
- CAS
1310383-07-3- Standard SMILES
Cc1ccc(F)c(B2OC(C)(C)C(C)(C)O2)n1- InChIKey
GCFQFORPGPAHQX-UHFFFAOYSA-N- Molecular formula
- C12H17BFNO2
- Average molar mass
- 237.08 g/mol
- Monoisotopic mass
- 237.1336371
Names & identifiers
- Preferred name
- 3-Fluoro-6-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
- IUPAC
- 3-fluoro-6-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
- English name
- 3-Fluoro-6-methylpyridine-2-boronic acid pinacol ester
- Molecular formula
- C12H17BFNO2
- Molecular weight
- 237.08
Names & synonyms
1310383-07-33-Fluoro-6-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine3-Fluoro-6-methylpyridine-2-boronic acid pinacol esterDTXSID30694471MFCD08063043AKOS015950153SY381977Pyridine, 3-fluoro-6-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
Database identifiers
- CAS
1310383-07-3- PubChem CID
- 53398511
- DTXSID
DTXSID30694471
Properties
Computed structural properties
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Boiling point
- 307.9 · 307.9±42.0 °C(Predicted)
- Density
- 1.08 · 1.08±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.55 · 3.55±0.29(Predicted)
Chemistry & industry
Suppliers2 total
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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