Piperazine
Properties
- Molecular formula
- C4H10N2
- Molar mass
- 86.14 g/mol
- Exact mass
- 86.0844 Da
- Density
- 1.1 g/mL
- Melting point
- 106 °C
- Boiling point
- 146 °C
- pKa
- 5.33 (second nitrogen), 9.73 (first nitrogen)
- Water solubility
- 150 g/L (20 °C)
- logP
- -0.82Crippen estimate
- Polar surface area
- 24.1 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H314 Causes severe skin burns and eye damageSkin corrosion/irritation
- H317 May cause an allergic skin reactionSensitization, Skin
- H334 May cause allergy or asthma symptoms or breathing difficulties if inhaledSensitization, respiratory
- H361fd Suspected of damaging fertility; Suspected of damaging the unborn childReproductive toxicity
Harmonised EU classification (CLP Annex VI, index 612-057-00-4), via PubChem.
Precautionary statements
P203, P233, P260, P261, P264, P271, P272, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P321, P333+P317, P342+P316, P362+P364, P363, P403, P405, P501
Identifiers
CAS number
110-85-0SMILES
C1CNCCN1InChIKey
GLUUGHFHXGJENI-UHFFFAOYSA-NInChI
InChI=1S/C4H10N2/c1-2-6-4-3-5-1/h5-6H,1-4H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
18 names · show all
- Antiren
- 1,4-Diazacyclohexane
- Diethylenediamine
- Dispermine
- Hexahydropyrazine
- Lumbrical
- Piperazidine
- Pyrazine, hexahydro-
- Pyrazine hexahydride
- Pipersol
- 1,4-Piperazine
- Wurmirazin
- Worm-A-ton
- Eraverm
- Uvilon
- Vermex
- NSC 474
- Tetrahydro-1,4-diazine
Safety data sheets
One stored sheet lists this compound in section 3, matched by the CAS number 110-85-0. Each row opens the sheet with its composition and PDF.
Work with Piperazine
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
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.
Arpezine142-63-2Hydrate
Piperazine citrate144-29-6Salt
Piperazine adipate142-88-1Salt
Ogen7280-37-7Salt
Piperazine hydrochloride142-64-3Salt
Piperazine phosphate14538-56-8Salt
Piperazine, phosphate (1:?)1951-97-9Salt
Niclosamide piperazine salt34892-17-6Salt
Piperazine, phosphate, hydrate (1:1:1)18534-18-4Salt
Piperazine, 2-hydroxy-1,2,3-propanetricarboxylate (3:2), hydrate41372-10-5Salt
Similar compounds
Aziridine151-56-4100 % similar
Cyclen294-90-6100 % similar
1,4,7-Triazacyclononane4730-54-5100 % similar
Polyethylenimine9002-98-6100 % similar
Cyclen tetrahydrochloride10045-25-767 % similar
1,4,8,12-Tetraazacyclopentadecane15439-16-467 % similar
Cyclam295-37-467 % similar
1,4-Diazacycloheptane505-66-867 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.