Isopropylcyclohexylamine
Properties
- Molecular formula
- C9H19N
- Molar mass
- 141.26 g/mol
- Exact mass
- 141.1517 Da
- Boiling point
- 169–171 °C
- logP
- 2.32Crippen estimate
- Polar surface area
- 12.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H226 Flammable liquid and vapor100% of notifiers
- H315 Causes skin irritation97.7% of notifiers
- H319 Causes serious eye irritation97.7% of notifiers
- H335 May cause respiratory irritation97.7% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
1195-42-2SMILES
CC(C)NC1CCCCC1InChIKey
UYYCVBASZNFFRX-UHFFFAOYSA-NInChI
InChI=1S/C9H19N/c1-8(2)10-9-6-4-3-5-7-9/h8-10H,3-7H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Cyclohexanamine, N-(1-methylethyl)-
- Cyclohexylamine, N-isopropyl-
- N-(1-Methylethyl)cyclohexanamine
- N-Isopropylcyclohexylamine
- Cyclohexylisopropylamine
- N-Cyclohexyl-N-isopropylamine
- N-Isopropylcyclohexanamine
- N-Cyclohexylisopropylamine
- NSC 86132
- N-Isopropyl-N-cyclohexylamine
Work with Isopropylcyclohexylamine
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
Dicyclohexylamine101-83-761 % similar
Methylcyclohexylamine100-60-745 % similar
Diisopropylamine108-18-944 % similar
Cyclohexylethylamine5459-93-842 % similar
Dicyclohexylammonium nitrite3129-91-741 % similar
N,N',N''-Tricyclohexyl-1-methylsilanetriamine15901-40-340 % similar
Methylcyclohexane108-87-238 % similar
Diisopropylammonium chloride819-79-438 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.