Butyramide, N-(4-heptyl)-
Basic information
- CAS
40754-93-6- Standard SMILES
CCCC(=O)NC(CCC)CCC- InChIKey
LUMTXZJTGMBMOV-UHFFFAOYSA-N- Molecular formula
- C11H23NO
- Average molar mass
- 185.31 g/mol
- Monoisotopic mass
- 185.17796436
Names & identifiers
- Preferred name
- Butyramide, N-(4-heptyl)-
- IUPAC
- N-heptan-4-ylbutanamide
- English name
- N-(1-Propylbutyl)butyramide
- Molecular formula
- C11H23NO
- Molecular weight
- 185.31
Names & synonyms
N-(4-Heptyl)butyramideN-(1-Propylbutyl)butyramideBUTYRAMIDE, N-(4-HEPTYL)-40754-93-6BRN 2432270DTXSID50193734RefChem:331202DTXCID90116225N-(HEPTAN-4-YL)BUTANAMIDEButanamide, N-(1-propylbutyl)-
Database identifiers
- CAS
40754-93-6- PubChem CID
- 38663
- DTXSID
DTXSID50193734- Nikkaji
- J42.765I
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 128
Physicochemical properties
- Boiling point
- 263.4 · 263.4±8.0 °C(Predicted)
- Density
- 0.856 · 0.856±0.06 g/cm3(Predicted)
- pka
- 16.19 · 16.19±0.46(Predicted)
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Compound notes
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