3-Hydroxypiperidine hydrochloride

C5H12ClNOCAS 64051-79-2137.61 g/mol

Open in Covalent MOL file
HClHONH
AlcoholSecondary amine

Properties

Molecular formula
C5H12ClNO
Molar mass
137.61 g/mol
Exact mass
137.0607 Da
Melting point
249–250 °C
logP
0.15Crippen estimate
Polar surface area
32.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
64051-79-2
SMILES
Cl.OC1CCCNC1
InChIKey
VLECDMDGMKPUSK-UHFFFAOYSA-N
InChI
InChI=1S/C5H11NO.ClH/c7-5-2-1-3-6-4-5;/h5-7H,1-4H2;1H

Weigh it out

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

Names and synonyms

3 names
  • 3-Piperidinol, hydrochloride (1:1)
  • 3-Piperidinol, hydrochloride
  • Piperidine-3-ol hydrochloride

Work with 3-Hydroxypiperidine 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

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.

3-Hydroxypiperidine6859-99-0Free base (R)-3-Hydroxypiperidine hydrocloride198976-43-1Defined stereoisomer (S)-3-Hydroxypiperidine hydrochloride475058-41-4Defined stereoisomer

Similar compounds

(R)-(-)-3-Pyrrolidinol hydrochloride104706-47-074 % similar (S)-3-Hydroxypyrrolidine hydrochloride122536-94-174 % similar 3-Hydroxypyrrolidine hydrochloride86070-82-874 % similar (+)-3-Pyrrolidinol100243-39-861 % similar (-)-3-Pyrrolidinol2799-21-561 % similar 3-Pyrrolidinol40499-83-061 % similar 3-Hydroxyazetidine hydrochloride18621-18-657 % similar 4-Hydroxypiperidinium chloride5382-17-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(3S)-3-Methylmorpholine hydrochloride1022094-03-6 (2S)-2-Methylmorpholine hydrochloride1147108-99-3 (1R,3S)-3-Aminocyclopentanol hydrochloride1279032-31-3 (1R,2S)-2-Aminocyclopentanol hydrochloride137254-03-6 1,4-Oxazepane hydrochloride178312-62-4 (Tetrahydrofuran-3-yl)methanamine hydrochloride184950-35-4 cis-(1S,2R)-2-Aminocyclopentanol hydrochloride225791-13-9

Elsewhere

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