Cyclohexylethylamine

C₈H₁₇NCAS 5459-93-8127.23 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₈H₁₇N
Molar mass: 127.23 g/mol
Exact mass: 127.1361 Da
Density: 0.868 g/mL (at 0 °C)
Melting point: −45 °C
Boiling point: 164 °C
Flash point: 29.4 °C (closed cup)
logP: 1.93Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Danger

H226 Flammable liquid and vapor100% of notifiers
H302+H332 Harmful if swallowed or if inhaled67% of notifiers
H302 Harmful if swallowed100% of notifiers
H311 Toxic in contact with skin100% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage67% of notifiers
H332 Harmful if inhaled89.6% of notifiers
H412 Harmful to aquatic life with long lasting effects67% of notifiers

Aggregated from 212 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, P273, 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+P235, P405, P501

Identifiers

CAS number

5459-93-8

SMILES

CCNC1CCCCC1

InChIKey

AGVKXDPPPSLISR-UHFFFAOYSA-N

InChI

InChI=1S/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H3

Weigh it out

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

Names and synonyms

12 names

Cyclohexanamine, N-ethyl-
Cyclohexylamine, N-ethyl-
N-Ethylcyclohexanamine
Accelerator HX
N-Ethylcyclohexylamine
N-Cyclohexylethylamine
Vulkacit HX
(Ethylamino)cyclohexane
N-Cyclohexyl-N-ethylamine
NSC 6272
N-Ethyl-N-cyclohexylamine
N-Ethyl cyclohexylamine

Work with Cyclohexylethylamine

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

(3S)-N-Ethyl-3-pyrrolidinamine381670-31-148 % similar Methylcyclohexylamine100-60-745 % similar Dicyclohexylamine101-83-745 % similar N-[(Triethoxysilyl)methyl]cyclohexanamine26495-91-045 % similar 2-Ethylpiperidine1484-80-644 % similar 2-(Cyclohexylamino)ethanol2842-38-844 % similar N-Cyclohexyl-1,3-propanediamine3312-60-542 % similar N-2-Propen-1-ylcyclohexanamine6628-00-842 % similar

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

Same formula

(S)-(+)-1-Cyclohexylethylamine17430-98-7 4-Propylpiperidine22398-09-0 Coniine3238-60-6 Cyclooctylamine5452-37-9 (-)-1-Cyclohexylethylamine5913-13-3 1-Butylpyrrolidine767-10-2 N,N-Dimethylcyclohexylamine98-94-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook