N-Propyl-1-hexamine
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Basic information
- CAS
20193-23-1- Standard SMILES
CCCCCCNCCC- InChIKey
WBLXZSQLBOFHAB-UHFFFAOYSA-N- Molecular formula
- C9H21N
- Average molar mass
- 143.27 g/mol
- Monoisotopic mass
- 143.16739967
Names & identifiers
- Preferred name
- N-Propyl-1-hexamine
- IUPAC
- N-propylhexan-1-amine
- English name
- hexyl(propyl)amine
- Molecular formula
- C9H21N
- Molecular weight
- 143.27
Names & synonyms
N-PROPYL-1-HEXAMINE20193-23-1DTXSID10174024RefChem:1092080DTXCID5096515Hexylamine, N-propyl-N-propylhexan-1-amineHexylpropylamineN-PropylhexylamineHEXYL(PROPYL)AMINE1-Hexanamine, N-propyl-N-n-propylhexylamine
Show more names
N-Propyl-1-hexanamine
n-Hexyl-n-propylamine #SCHEMBL386693SCHEMBL386694SCHEMBL465480SCHEMBL3065270SCHEMBL3690400SCHEMBL8694717WBLXZSQLBOFHAB-UHFFFAOYSA-N
Database identifiers
- CAS
20193-23-1- PubChem CID
- 29996
- DTXSID
DTXSID10174024- Nikkaji
- J113.946K
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 52.7
Physicochemical properties
- Boiling point
- 171 · 171-181 °C(Press: 753 Torr)
- Density
- 0.77 · 0.770±0.06 g/cm3(Predicted)
- pka
- 11.11 · 11.11±0.19(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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