N-(2,2-Difluoroethyl)dodecan-1-amine
Basic information
- CAS
71113-62-7- Standard SMILES
CCCCCCCCCCCCNCC(F)F- InChIKey
MVNZMMIDZCQIPW-UHFFFAOYSA-N- Molecular formula
- C14H29F2N
- Average molar mass
- 249.38 g/mol
- Monoisotopic mass
- 249.22680625
Names & identifiers
- Preferred name
- N-(2,2-Difluoroethyl)dodecan-1-amine
- IUPAC
- N-(2,2-difluoroethyl)dodecan-1-amine
Names & synonyms
N-(2,2-Difluoroethyl)dodecan-1-amine71113-62-7CHEMBL3246097SCHEMBL10680862DTXSID50603040MVNZMMIDZCQIPW-UHFFFAOYSA-N
Database identifiers
- CAS
71113-62-7- PubChem CID
- 20155641
- DTXSID
DTXSID50603040- ChEMBL
CHEMBL3246097
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 13
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 140
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…