Basic information
- CAS
36874-77-8- Standard SMILES
CCCCN(CCC)CCCC- InChIKey
VEBPYKMCKZTFPJ-UHFFFAOYSA-N- Molecular formula
- C11H25N
- Average molar mass
- 171.32 g/mol
- Monoisotopic mass
- 171.1986998
Names & identifiers
- Preferred name
- 1-Butanamine, N-butyl-N-propyl-
- IUPAC
- N-butyl-N-propylbutan-1-amine
- English name
- Dibutyl-propyl-amine
- Molecular formula
- C11H25N
- Molecular weight
- 171.32
Names & synonyms
N-Propyldibutylamine1-Butanamine, N-butyl-N-propyl-N-Butyl-N-propyl-1-butanamineDibutyl propyl amineDTXSID60190355RefChem:228748DTXCID701128461-Butanamine, N-butyl-N-propyl-(9CI)VEBPYKMCKZTFPJ-UHFFFAOYSA-N36874-77-8N-butyl-N-propylbutan-1-amineNSC 13550
Show more names
Dibutyl-propyl-amine
UY95LW99FKNSC-13550dibutylpropylamineNSC135501-Butanamine, N-butyl-N-propyl- (9CI)UNII-UY95LW99FKSCHEMBL128596SCHEMBL218572
Database identifiers
- CAS
36874-77-8- PubChem CID
- 95010
- DTXSID
DTXSID60190355- UNII
- UY95LW99FK
- Nikkaji
- J581.347F
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 73.1
Physicochemical properties
- Boiling point
- 198.7 · 198.7±8.0 °C(Predicted)
- Density
- 0.788 · 0.788±0.06 g/cm3(Predicted)
- pka
- 9.99 · 9.99±0.50(Predicted)
- FDA UNII
- 95 LW99FK · UY95LW99FK
Chemistry & industry
Suppliers4 total
APAC Pharmaceutical, LLC[email protected]
HONEST JOY HOLDINGS LIMITED[email protected]
Leancare Ltd.[email protected]
CHEMPACIFIC[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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