chempirical

Cyclohexanemethanamine

C7H15NCAS 3218-02-8113.20 g/mol

Open in Covalent MOL file
H2N
Primary amine

Properties

Molecular formula
C7H15N
Molar mass
113.20 g/mol
Exact mass
113.1204 Da
Density
0.8746 g/mL (at 14 °C)
Melting point
162–163 °C
Boiling point
160 °C
logP
1.53Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Danger
Flammable (GHS02)Corrosive (GHS05)

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number
3218-02-8
SMILES
NCC1CCCCC1
InChIKey
AVKNGPAMCBSNSO-UHFFFAOYSA-N
InChI
InChI=1S/C7H15N/c8-6-7-4-2-1-3-5-7/h7H,1-6,8H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names
  • Cyclohexanemethylamine
  • Cyclohexylmethanamine
  • (Aminomethyl)cyclohexane
  • NSC 172991
  • 1-Cyclohexylmethanamine
  • C-Cyclohexyl-methylamine
  • Cyclohexylmethyleneamine

Work with Cyclohexanemethanamine

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

Similar compounds

Cyclobutanemethanamine4415-83-280 % similar Aminomethylcyclopentane hydrochloride58714-85-576 % similar 2-n-Octyl-1-dodecylamine62281-06-570 % similar Cyclopropanemethanamine2516-47-467 % similar 1,4-Cyclohexanedimethanamine2549-93-167 % similar Cyclobutylmethylamine hydrochloride5454-82-067 % similar 1,3-BAC2579-20-661 % similar 4-Aminomethyltetrahydropyran130290-79-850 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methylcyclohexylamine100-60-7 Azocane1121-92-2 3,3-Dimethylpiperidine1193-12-0 2-Ethylpiperidine1484-80-6 trans-4-Methylcyclohexylamine2523-55-9 (Cyclopropylmethyl)propylamine26389-60-6 3,5-Dimethylpiperidine35794-11-7 2,6-Dimethylpiperidine504-03-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook