Azetidine
Properties
- Molecular formula
- C3H7N
- Molar mass
- 57.10 g/mol
- Exact mass
- 57.0578 Da
- Density
- 0.8412 g/mL (at 24 °C)
- Melting point
- −45.3 °C
- Boiling point
- 63 °C
- pKa
- 11.3
- logP
- -0.02Crippen estimate
- Polar surface area
- 12.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H225 Highly Flammable liquid and vapor100% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, P501
Identifiers
CAS number
503-29-7SMILES
C1CNC1InChIKey
HONIICLYMWZJFZ-UHFFFAOYSA-NInChI
InChI=1S/C3H7N/c1-2-4-3-1/h4H,1-3H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Azacyclobutane
- Azete, tetrahydro-
- Trimethylenimine
- 1,3-Propylenimine
Reactions
Work with Azetidine
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.
Similar compounds
1,4,8,12-Tetraazacyclopentadecane15439-16-489 % similar
Cyclam295-37-489 % similar
1,4-Diazacycloheptane505-66-889 % similar
Pyrrolidine123-75-178 % similar
Piperidine110-89-470 % similar
Azepane111-49-970 % similar
Azocane1121-92-270 % similar
Norspermine4605-14-557 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds