Mandelamide, o-bromo-
Completing data — refresh the page later to see the latest
Basic information
- CAS
21165-17-3- Standard SMILES
NC(=O)C(O)c1ccccc1Br- InChIKey
XAYZXQZIAWRUEB-UHFFFAOYSA-N- Molecular formula
- C8H8BrNO2
- Average molar mass
- 230.06 g/mol
- Monoisotopic mass
- 228.97384
Names & identifiers
- Preferred name
- Mandelamide, o-bromo-
- IUPAC
- 2-(2-bromophenyl)-2-hydroxyacetamide
- English name
- Mandelamide, o-bromo- (8CI)
- Molecular formula
- C8H8BrNO2
- Molecular weight
- 230.06
Names & synonyms
Mandelamide, o-bromo-XAYZXQZIAWRUEB-UHFFFAOYSA-NAKOS0115065472-(2-Bromophenyl)-2-hydroxyacetamide #Mandelamide, o-bromo- (8CI)Benzeneacetamide, 2-bromo-α-hydroxy-
Database identifiers
- CAS
21165-17-3- PubChem CID
- 555717
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 97.5 °C · 97.5 °C
- Boiling point
- 123 · 123-126 °C
- Density
- 1.673 · 1.673±0.06 g/cm3(Predicted)
- pka
- 12.05 · 12.05±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…