Basic information
- CAS
1609348-50-6- Standard SMILES
NCC(N)CC(F)(F)F- InChIKey
UKZKRKSQKMVRJD-UHFFFAOYSA-N- Molecular formula
- C4H9F3N2
- Average molar mass
- 142.12 g/mol
- Monoisotopic mass
- 142.07178278
Names & identifiers
- Preferred name
- 4,4,4-Trifluorobutane-1,2-diamine
- IUPAC
- 4,4,4-trifluorobutane-1,2-diamine
Names & synonyms
4,4,4-trifluorobutane-1,2-diamine1609348-50-6SCHEMBL6321617UKZKRKSQKMVRJD-UHFFFAOYSA-NDTXSID3013003774,4,4-Trifluoro-1,2-butanediamineEN300-4573724
Database identifiers
- CAS
1609348-50-6- PubChem CID
- 22562016
- DTXSID
DTXSID301300377
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 80.4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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