Hexylamine
Properties
- Molecular formula
- C6H15N
- Molar mass
- 101.19 g/mol
- Exact mass
- 101.1204 Da
- Density
- 0.77 g/mL
- Melting point
- −22.9 °C
- Boiling point
- 131–132 °C
- Flash point
- 27 °C (closed cup)
- Water solubility
- 12 g/L
- logP
- 1.53Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 4
Hazards
Danger
- H226 Flammable liquid and vapor95.2% of notifiers
- H301+H311 Toxic if swallowed or in contact with skin16.3% of notifiers
- H301 Toxic if swallowed61.8% of notifiers
- H302 Harmful if swallowed33.9% of notifiers
- H311 Toxic in contact with skin63.3% of notifiers
- H312 Harmful in contact with skin31.9% of notifiers
- H314 Causes severe skin burns and eye damage95.6% of notifiers
- H318 Causes serious eye damage45.8% of notifiers
- H411 Toxic to aquatic life with long lasting effects15.9% of notifiers
- H412 Harmful to aquatic life with long lasting effects44.2% of notifiers
Aggregated from 251 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P262, P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P362+P364, P363, P370+P378, P391, P403+P235, P405, P501
Identifiers
CAS number
111-26-2SMILES
CCCCCCNInChIKey
BMVXCPBXGZKUPN-UHFFFAOYSA-NInChI
InChI=1S/C6H15N/c1-2-3-4-5-6-7/h2-7H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- 1-Hexanamine
- 1-Aminohexane
- n-Hexylamine
- Mono-n-hexylamine
- 1-Hexylamine
- ENT 16554
- NSC 2590
- 1-Hexaneamine
Work with Hexylamine
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Heptylamine111-68-2100 % similar
Octylamine111-86-4100 % similar
Nonylamine112-20-9100 % similar
Dodecylamine124-22-1100 % similar
Octadecylamine124-30-1100 % similar
1-Aminononadecane14130-05-3100 % similar
Hexadecylamine143-27-1100 % similar
Tetradecylamine2016-42-4100 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.