Basic information
- Standard SMILES
CCCCCCCCNC(=O)NCCCC.O=S(=O)(O)C(F)(F)F- InChIKey
AYOKKAVERWNRNK-UHFFFAOYSA-N- Molecular formula
- C14H29F3N2O4S
- Average molar mass
- 378.45 g/mol
Names & identifiers
- Preferred name
- N-n-butyl-N'-octylurea triflate
- IUPAC
- 1-butyl-3-octylurea;trifluoromethanesulfonic acid
Names & synonyms
N-n-butyl-N'-octylurea triflateSCHEMBL9162287
Database identifiers
- PubChem CID
- 86747486
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 318
Related reactions
2 records
Compound notes
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