chempirical

Piperidinium acetate

C7H15NO2CAS 4540-33-4145.20 g/mol

Open in Covalent MOL file
NHOOH
Carboxylic acidSecondary amine

Properties

Molecular formula
C7H15NO2
Molar mass
145.20 g/mol
Exact mass
145.1103 Da
Density
0.94 g/mL
Boiling point
96–98 °C (at 9 Torr)
logP
0.85Crippen estimate
Polar surface area
49.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

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

Identifiers

CAS number
4540-33-4
SMILES
C1CCNCC1.CC(=O)O
InChIKey
RAIYODFGMLZUDF-UHFFFAOYSA-N
InChI
InChI=1S/C5H11N.C2H4O2/c1-2-4-6-5-3-1;1-2(3)4/h6H,1-5H2;1H3,(H,3,4)

Weigh it out

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

Names and synonyms

2 names
  • Piperidine, acetate (1:1)
  • Piperidine, acetate

Work with Piperidinium acetate

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.

Acetic acid64-19-7Free acid (2H3)Acetic (2H)acid1186-52-3Free acid, labelled Piperidine110-89-4Free base Potassium acetate127-08-2Salt Aluminium diacetate142-03-0Salt Calcium acetate62-54-4Salt Copper(II) acetate142-71-2Salt Lead(II) acetate301-04-2Salt Mercury(II) acetate1600-27-7Salt Aluminium triacetate139-12-8Salt 4-Aminophenylmercuric acetate6283-24-5Salt Basic lead acetate1335-32-6Salt

Similar compounds

Palladium(II) acetate3375-31-350 % similar Antimony acetate3643-76-350 % similar Rhodium acetate42204-14-850 % similar Antimony(III) acetate6923-52-050 % similar Zirconium acetate7585-20-850 % similar Azepane111-49-943 % similar Azocane1121-92-243 % similar Dioctylamine1120-48-538 % similar

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

Same formula

2-Aminoheptanoic acid1115-90-8 α-Methyl-4-morpholineethanol2109-66-2 3-Morpholino-1-propanol4441-30-9 7-Aminoheptanoic acid929-17-9

Elsewhere

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