4-Aminocyclohexaneethanol

C8H17NOCAS 857831-26-6143.23 g/mol

Open in Covalent MOL file
HONH2
AlcoholPrimary amine

Properties

Molecular formula
C8H17NO
Molar mass
143.23 g/mol
Exact mass
143.1310 Da
logP
0.89Crippen estimate
Polar surface area
46.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
857831-26-6
SMILES
C1CC(CCC1CCO)N
InChIKey
XLKSLYGRARRUJP-UHFFFAOYSA-N
InChI
InChI=1S/C8H17NO/c9-8-3-1-7(2-4-8)5-6-10/h7-8,10H,1-6,9H2

Weigh it out

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

Names and synonyms

1 names
  • rac-2-((1r,4r)-4-Aminocyclohexyl)ethan-1-ol

Work with 4-Aminocyclohexaneethanol

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

2-Cyclopropylethanol2566-44-167 % similar ((1s,4s)-4-Aminocyclohexyl)methanol1467-84-159 % similar 4,4′-Diaminodicyclohexylmethane1761-71-352 % similar Cyclopentaneethanol766-00-752 % similar trans-1,4-Diaminocyclohexane2615-25-050 % similar 1,4-Diaminocyclohexane3114-70-350 % similar Cyclohexylethanol4442-79-950 % similar Cyclopropylamine765-30-050 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Piperidinepropanol104-58-5 2-(4-Piperidyl)-2-propanol22990-34-7 Valpromide2430-27-5 2-(Cyclohexylamino)ethanol2842-38-8 4-(Diethylamino)butan-2-one3299-38-5 1-Dimethylamino-2-methylpentan-3-one51690-03-0 N,N-Dimethylhexanamide5830-30-8 4-Piperidinepropanol7037-49-2

Elsewhere

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