3-Azetidinol

C₃H₇NOCAS 45347-82-873.09 g/mol

Open in Covalent MOL file

Alcohol Secondary amine

Properties

Molecular formula: C₃H₇NO
Molar mass: 73.09 g/mol
Exact mass: 73.0528 Da
logP: -1.05Crippen estimate
Polar surface area: 32.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

45347-82-8

SMILES

C1C(CN1)O

InChIKey

GMWFCJXSQQHBPI-UHFFFAOYSA-N

InChI

InChI=1S/C3H7NO/c5-3-1-4-2-3/h3-5H,1-2H2

Weigh it out

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

Names and synonyms

1 names

3-Hydroxyazetidine

Work with 3-Azetidinol

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-Hydroxyazetidine hydrochloride18621-18-6Salt

Similar compounds

(+)-3-Pyrrolidinol100243-39-856 % similar (-)-3-Pyrrolidinol2799-21-556 % similar 3-Pyrrolidinol40499-83-056 % similar 3-Hydroxypiperidine6859-99-050 % similar (R)-(-)-3-Pyrrolidinol hydrochloride104706-47-048 % similar (S)-3-Hydroxypyrrolidine hydrochloride122536-94-148 % similar 3-Hydroxypyrrolidine hydrochloride86070-82-848 % similar Piperidin-4-ol5382-16-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Acetone oxime127-06-0 3-Oxetanamine21635-88-1 Deuterated dmf4472-41-7 Ethylformamide627-45-2 Dimethylformamide68-12-2 Propanamide79-05-0 N-Methylacetamide79-16-3

Elsewhere

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