3-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-ol
Basic information
- CAS
1333319-76-8- Standard SMILES
CC1(C)OB(c2c[nH]c(=O)c(F)c2)OC1(C)C- InChIKey
PYHFMUZWRDHWKE-UHFFFAOYSA-N- Molecular formula
- C11H15BFNO3
- Average molar mass
- 239.05 g/mol
- Monoisotopic mass
- 239.1129017
Names & identifiers
- Preferred name
- 3-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-ol
- IUPAC
- 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyridin-2-one
- English name
- 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-ol
- Molecular formula
- C11H15BFNO3
- Molecular weight
- 239.05
Names & synonyms
3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-olRefChem:501813887-105-21333319-76-83-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyridin-2-oneMFCD169952712(1H)-Pyridinone, 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one5-Fluoro-6-hydroxypyridine-3-boronic Acid Pinacol EsterSCHEMBL18895034SCHEMBL22690886DTXSID20725460
Show more names
3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan- 2-yl)-1,2-dihydropyridin-2-one
2-yl)-1,2-dihydropyridin-2-oneAKOS016844710DS-6965MB17727SY108370CS-0144774C72330EN300-1706296
Database identifiers
- CAS
1333319-76-8- PubChem CID
- 57415697
- DTXSID
DTXSID20725460- EC Number
- 887-105-2
Properties
Computed structural properties
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 412
Physicochemical properties
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 10.92 · 10.92±0.10(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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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