trans-4-Methylcyclohexylamine hydrochloride

C₇H₁₆ClNCAS 33483-65-7149.66 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₆ClN
Molar mass: 149.66 g/mol
Exact mass: 149.0971 Da
Melting point: 260 °C
logP: 1.95Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0
Stereocentres: r, rin SMILES atom order

Identifiers

CAS number

33483-65-7

SMILES

C[C@H]1CC[C@H](N)CC1.Cl

InChIKey

GIRKJSRZELQHDX-MEZFUOHNNA-N

InChI

InChI=1/C7H15N.ClH/c1-6-2-4-7(8)5-3-6;/h6-7H,2-5,8H2,1H3;1H/t6-,7-;

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

Names and synonyms

4 names

Cyclohexanamine, 4-methyl-, hydrochloride (1:1), trans-
Cyclohexylamine, 4-methyl-, hydrochloride, trans-
Cyclohexanamine, 4-methyl-, hydrochloride, trans-
trans-4-Methylcyclohexanamine hydrochloride

Work with trans-4-Methylcyclohexylamine hydrochloride

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

trans-4-Methylcyclohexylamine2523-55-983 % similar 4-Methylcyclohexylamine6321-23-983 % similar Cyclobutylammonium chloride6291-01-652 % similar trans-1,4-Diaminocyclohexane2615-25-050 % similar 1,4-Diaminocyclohexane3114-70-350 % similar Cyclohexylammonium chloride4998-76-950 % similar trans-4-Aminocyclohexanol hydrochloride50910-54-850 % similar 1,4-Dimethylcyclohexane589-90-250 % similar

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

Same formula

3-Chloro-N,N-diethyl-1-propanamine104-77-8 Mepiquat chloride24307-26-4

Elsewhere

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