6-Methyl-3-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Basic information
- CAS
1310384-91-8- Standard SMILES
Cc1ccc([N+](=O)[O-])c(B2OC(C)(C)C(C)(C)O2)n1- InChIKey
MCUGBOXKQIFHEP-UHFFFAOYSA-N- Molecular formula
- C12H17BN2O4
- Average molar mass
- 264.09 g/mol
- Monoisotopic mass
- 264.1281372
Names & identifiers
- Preferred name
- 6-Methyl-3-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
- IUPAC
- 6-methyl-3-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
- English name
- 6-Methyl-3-nitropyridine-2-boronic acid pinacol ester
- Molecular formula
- C12H17BN2O4
- Molecular weight
- 264.09
Names & synonyms
1310384-91-86-Methyl-3-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine6-Methyl-3-nitropyridine-2-boronic acid pinacol esterDTXSID50694473AKOS015950173Pyridine, 6-methyl-3-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
Database identifiers
- CAS
1310384-91-8- PubChem CID
- 53398514
- DTXSID
DTXSID50694473
Properties
Computed structural properties
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 353
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…