Basic information
- CAS
33021-75-9- Standard SMILES
O=C(NCCF)NCC(F)(F)F- InChIKey
VVDWYMKGHXJNNY-UHFFFAOYSA-N- Molecular formula
- C5H8F4N2O
- Average molar mass
- 188.12 g/mol
- Monoisotopic mass
- 188.05727553
Names & identifiers
- Preferred name
- 1-(2-Fluoroethyl)-3-(2,2,2-trifluoroethyl)urea
- IUPAC
- 1-(2-fluoroethyl)-3-(2,2,2-trifluoroethyl)urea
Names & synonyms
33021-75-91-(2-fluoroethyl)-3-(2,2,2-trifluoroethyl)ureaNSC101572DTXSID40295372NSC-101572N-(2-Fluoroethyl)-N'-(2,2,2-trifluoroethyl)urea
Database identifiers
- CAS
33021-75-9- PubChem CID
- 265489
- DTXSID
DTXSID40295372
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 147
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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