2-Methylcyclohexylamine

C₇H₁₅NCAS 7003-32-9113.20 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₅N
Molar mass: 113.20 g/mol
Exact mass: 113.1204 Da
Density: 0.88 g/mL
Boiling point: 150 °C
logP: 1.52Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H226 Flammable liquid and vapor96.5% of notifiers
H302 Harmful if swallowed96.5% of notifiers
H311 Toxic in contact with skin12.8% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage61% of notifiers
H331 Toxic if inhaled12.8% of notifiers

Aggregated from 172 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

7003-32-9

SMILES

CC1CCCCC1N

InChIKey

FEUISMYEFPANSS-UHFFFAOYSA-N

InChI

InChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3

Weigh it out

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

Names and synonyms

7 names

Cyclohexanamine, 2-methyl-
Cyclohexylamine, 2-methyl-
2-Methylcyclohexanamine
o-Methylcyclohexylamine
NSC 27455
1-Amino-2-methylcyclohexane
2-Methylcyclohexan-1-amine

Work with 2-Methylcyclohexylamine

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

trans-1,2-Diaminocyclohexane1121-22-856 % similar cis-1,2-Cyclohexanediamine1436-59-556 % similar (-)-trans-1,2-Diaminocyclohexane20439-47-856 % similar (+)-trans-1,2-Diaminocyclohexane21436-03-356 % similar cis-1,2-Dimethylcyclohexane2207-01-456 % similar 1,2-Dimethylcyclohexane583-57-356 % similar trans-1,2-Dimethylcyclohexane6876-23-956 % similar 1,2-Diaminocyclohexane694-83-756 % 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 Cyclohexanemethanamine3218-02-8 3,5-Dimethylpiperidine35794-11-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook