trans-4-Aminocyclohexanol

C6H13NOCAS 27489-62-9115.18 g/mol

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H2NOH
AlcoholPrimary amine

Properties

Molecular formula
C6H13NO
Molar mass
115.18 g/mol
Exact mass
115.0997 Da
logP
0.25Crippen estimate
Polar surface area
46.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0
Stereocentres
r, rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
27489-62-9
SMILES
N[C@H]1CC[C@H](O)CC1
InChIKey
IMLXLGZJLAOKJN-IZLXSQMJNA-N
InChI
InChI=1/C6H13NO/c7-5-1-3-6(8)4-2-5/h5-6,8H,1-4,7H2/t5-,6-

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Names and synonyms

8 names
  • Cyclohexanol, 4-amino-, trans-
  • 4-trans-Hydroxycyclohexylamine
  • trans-4-Hydroxycyclohexylamine
  • trans-1-Amino-4-cyclohexanol
  • trans-4-Amino-1-cyclohexanol
  • trans-1,4-Cyclohexanolamine
  • 4-trans-Aminocyclohexanol
  • trans-1-Amino-4-hydroxycyclohexane

Work with trans-4-Aminocyclohexanol

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

4-Aminocyclohexanol6850-65-3Stereo not defined trans-4-Aminocyclohexanol hydrochloride50910-54-8Salt

Similar compounds

Cyclopropanol16545-68-960 % similar trans-1,4-Diaminocyclohexane2615-25-060 % similar 1,4-Diaminocyclohexane3114-70-360 % similar 1,4-Cyclohexanediol556-48-960 % similar trans-1,4-Cyclohexanediol6995-79-560 % similar Cyclopropylamine765-30-060 % similar (1R,3S)-3-Aminocyclopentanol hydrochloride1279032-31-359 % similar [1,1′-Bicyclohexyl]-4,4′-diol20601-38-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethylmorpholine100-74-3 [1-Aminocyclopentyl]methanol10316-79-7 4-Hydroxy-1-methylpiperidine106-52-5 4-Aminomethyltetrahydropyran130290-79-8 1-Propylazetidin-3-ol1340301-52-1 2,6-Dimethylmorpholine141-91-3 (3S)-Piperidin-3-ylmethanol144539-77-5 2,6-Dimethylmorpholine, (2R,6R)-171753-74-5

Elsewhere

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