(1R)-1-[(2R)-2-(2,5-difluorophenyl)oxiran-2-yl]ethanol
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Basic information
- CAS
832152-04-2- Standard SMILES
C[C@@H](O)[C@@]1(c2cc(F)ccc2F)CO1- InChIKey
JMTUKLDCKFYSIK-LHLIQPBNSA-N- Molecular formula
- C10H10F2O2
- Average molar mass
- 200.18 g/mol
Names & identifiers
- Preferred name
- (1R)-1-[(2R)-2-(2,5-difluorophenyl)oxiran-2-yl]ethanol
- IUPAC
- (1R)-1-[(2R)-2-(2,5-difluorophenyl)oxiran-2-yl]ethanol
- English name
- Oxiranemethanol,2-(2,5-difluorophenyl)--alpha--methyl-,(-alpha-R,2R)-(9CI)
- Molecular formula
- C10H10F2O2
- Molecular weight
- 200.18
Names & synonyms
SCHEMBL9387702-Oxiranemethanol, 2-(2,5-difluorophenyl)-α-methyl-, (αR,2R)-Oxiranemethanol,2-(2,5-difluorophenyl)--alpha--methyl-,(-alpha-R,2R)-(9CI)
Database identifiers
- CAS
832152-04-2- Nikkaji
- J2.402.093B
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 224
Physicochemical properties
- Boiling point
- 281.2 · 281.2±40.0 °C(Predicted)
- Density
- 1.348 · 1.348±0.06 g/cm3(Predicted)
- pka
- 14.51 · 14.51±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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