Basic information
- CAS
2244893-49-8- Standard SMILES
CC1(C)OB(c2cc(O)cc(F)c2F)OC1(C)C- InChIKey
MRRIMYHDASDOCL-UHFFFAOYSA-N- Molecular formula
- C12H15BF2O3
- Average molar mass
- 256.06 g/mol
- Monoisotopic mass
- 256.1082308
Names & identifiers
- Preferred name
- 3,4-Difluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
- IUPAC
- 3,4-difluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
- English name
- Phenol, 3,4-difluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- Molecular formula
- C12H15BF2O3
- Molecular weight
- 256.05
Names & synonyms
3,4-Difluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol2244893-49-8MFCD28515402XH0300SY291184CS-0178940G68155F6238052,3-Difluoro-5-hydroxyphenylboronic Acid Pinacol Ester3,4-Difluoro-1-hydroxybenzene-5-boronic Acid Pinacol EsterPhenol, 3,4-difluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-Fluoro-25-(methylthio)pyridine
Database identifiers
- CAS
2244893-49-8- PubChem CID
- 119007507
Properties
Computed structural properties
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 308
Physicochemical properties
- Boiling point
- 362.7 · 362.7±42.0 °C(Predicted)
- Density
- 1.2 · 1.20±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- pka
- 9.05 · 9.05±0.23(Predicted)
- Appearance
- Off-white to light yellow Solid
- 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
Chemistry & industry
Suppliers18 total
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
湖州澄泓生物技术有限公司13626726938 · [email protected]
广州科瑞生物技术有限公司20-66003216 18666003216 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
湖州清硫硅生物科技有限公司13626726938 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
郑州艾克姆化工有限公司0371-0371-55629727 13323845623 · [email protected]
湖州澄博生物科技有限公司13626726938
西安峥鎏生物科技有限公司15594552852 · [email protected]
杭州博洛科生物科技有限公司13757158499; 13757158499 · [email protected]
上海丸全化学科技有限公司18721745940 · [email protected]
嘉兴瑞恒生物科技有限公司0573-0573-82672231 13757365595 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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