Basic information
- CAS
63690-12-0- Standard SMILES
CCCCC(C)(C)NC- InChIKey
ZBEGTFAZGLQTOB-UHFFFAOYSA-N- Molecular formula
- C8H19N
- Average molar mass
- 129.24 g/mol
- Monoisotopic mass
- 129.15174961
Names & identifiers
- Preferred name
- 2-Hexylamine, N,2-dimethyl-
- IUPAC
- N,2-dimethylhexan-2-amine
- English name
- N,2-Dimethyl-2-hexanamine
- Molecular formula
- C8H19N
- Molecular weight
- 129.24
Names & synonyms
2-HEXYLAMINE, N,2-DIMETHYL-63690-12-02-Methyl-2-hexyl-methylamine2-Hexanamine, N,2-dimethyl-DTXSID80213090RefChem:261465DTXCID80135581methyl(2-methylhexan-2-yl)amineN,2-Dimethyl-2-hexanamineN,2-dimethylhexan-2-amineSCHEMBL385691SCHEMBL8122880
Show more names
DB-308749EN300-1858572
Database identifiers
- CAS
63690-12-0- PubChem CID
- 44595
- DTXSID
DTXSID80213090- Nikkaji
- J77.681E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 67
Physicochemical properties
- Boiling point
- 142.7 · 142.7±8.0 °C(Predicted)
- Density
- 0.762 · 0.762±0.06 g/cm3(Predicted)
- pka
- 11.17 · 11.17±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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