1-(2-Fluoroethyl)-3-(4-methylcyclohexyl)urea
Basic information
- CAS
33021-77-1- Standard SMILES
CC1CCC(NC(=O)NCCF)CC1- InChIKey
DTQCSUNFELQYOZ-UHFFFAOYSA-N- Molecular formula
- C10H19FN2O
- Average molar mass
- 202.27 g/mol
- Monoisotopic mass
- 202.1481414
Names & identifiers
- Preferred name
- 1-(2-Fluoroethyl)-3-(4-methylcyclohexyl)urea
- IUPAC
- 1-(2-fluoroethyl)-3-(4-methylcyclohexyl)urea
Names & synonyms
33021-77-11-(2-fluoroethyl)-3-(4-methylcyclohexyl)ureaNSC125088DTXSID40298661NSC-125088N-(2-Fluoroethyl)-N'-(4-methylcyclohexyl)urea
Database identifiers
- CAS
33021-77-1- PubChem CID
- 276745
- DTXSID
DTXSID40298661
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…