tert-Butyl (2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamate
Basic information
- CAS
1310405-07-2- Standard SMILES
CC(C)(C)OC(=O)Nc1cc(B2OC(C)(C)C(C)(C)O2)cnc1F- InChIKey
WDSXXXQAKHAZAY-UHFFFAOYSA-N- Molecular formula
- C16H24BFN2O4
- Average molar mass
- 338.2 g/mol
- Monoisotopic mass
- 338.1813156
Names & identifiers
- Preferred name
- tert-Butyl (2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamate
- IUPAC
- tert-butyl N-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]carbamate
- English name
- 3-tert-Butyloxycarbonylamino-2-fluoropyridine-5-boronic acid pinacol ester
- Molecular formula
- C16H24BFN2O4
- Molecular weight
- 338.18
Names & synonyms
1310405-07-2tert-Butyl (2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamate3-TERT-BUTYLOXYCARBONYLAMINO-2-FLUOROPYRIDINE-5-BORONIC ACID PINACOL ESTERtert-butyl N-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamateMFCD08063061carbamic acid, N-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-, 1,1-dimethylethyl estertert-Butyl [2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamateTedizolidted Impurity 35DTXSID60694500AKOS015950199FD10438SB83550
Show more names
tert-butylN-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamate
tert-butyl N-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridyl]carbamatetert-Butyl(2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamateAS-48853CS-0362644F7537943-t-Butyloxycarbonylamino-2-fluoropyridine-5-boronic acid pinacol ester
Database identifiers
- CAS
1310405-07-2- PubChem CID
- 53398548
- DTXSID
DTXSID60694500
Properties
Computed structural properties
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 465
Physicochemical properties
- Boiling point
- 395.3 · 395.3±42.0 °C(Predicted)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 11.95 · 11.95±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Compound notes
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