Basic information
- CAS
1696588-54-1- Standard SMILES
OCC1CC1c1cc(F)cc(F)c1- InChIKey
VUBHQXODHNUPSH-UHFFFAOYSA-N- Molecular formula
- C10H10F2O
- Average molar mass
- 184.18 g/mol
- Monoisotopic mass
- 184.06997126
Names & identifiers
- Preferred name
- (2-(3,5-Difluorophenyl)cyclopropyl)methanol
- IUPAC
- [2-(3,5-difluorophenyl)cyclopropyl]methanol
- English name
- (2-(3，5-difluorophenyl)cyclopropyl)methanol
- Molecular formula
- C10H10F2O
- Molecular weight
- 184.18
Names & synonyms
(2-(3,5-Difluorophenyl)cyclopropyl)methanol1696588-54-1starbld0007434SCHEMBL28298513(2-(3，5-difluorophenyl)cyclopropyl)methanolCyclopropanemethanol, 2-(3,5-difluorophenyl)-
Database identifiers
- CAS
1696588-54-1- PubChem CID
- 106534652
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Physicochemical properties
- Boiling point
- 237.9 · 237.9±30.0 °C(Predicted)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- 15.1 · 15.10±0.10(Predicted)
Chemistry & industry
Suppliers3 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…