3-Morpholinone

C₄H₇NO₂CAS 109-11-5101.11 g/mol

Open in Covalent MOL file

Ether

Properties

Molecular formula: C₄H₇NO₂
Molar mass: 101.11 g/mol
Exact mass: 101.0477 Da
Melting point: 105 °C
logP: -0.03Crippen estimate
Polar surface area: 41.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed33.1% of notifiers
H315 Causes skin irritation26.8% of notifiers
H317 May cause an allergic skin reaction26.1% of notifiers
H318 Causes serious eye damage31.8% of notifiers
H335 May cause respiratory irritation26.1% of notifiers

Aggregated from 157 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

109-11-5

SMILES

OC1=NCCOC1

InChIKey

VSEAAEQOQBMPQF-UHFFFAOYSA-N

InChI

InChI=1S/C4H7NO2/c6-4-3-7-2-1-5-4/h1-3H2,(H,5,6)

Weigh it out

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

Names and synonyms

4 names

3-Ketomorpholine
3-Oxomorpholine
NSC 11688
3-Morpholone

Work with 3-Morpholinone

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

Similar compounds

17-Amino-10-oxo-3,6,12,15-tetraoxa-9-azaheptadecanoic acid1143516-05-558 % similar 2-Azetidinone930-21-243 % similar 2-Pyrrolidone616-45-540 % similar 2-Oxazolidone497-25-638 % similar 2-Piperidinone675-20-738 % similar Caprolactam105-60-237 % similar Enantholactam673-66-537 % similar Octahydro-2H-azonin-2-one935-30-837 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Hydroxy-2-pyrrolidinone15166-68-4 3-Methyl-2-oxazolidinone19836-78-3 Azetidine-2-carboxylic acid2133-34-8 1-Aminocyclopropane-1-carboxylic acid22059-21-8 (R)-(+)-4-Hydroxy-2-pyrrolidinone22677-21-0 (±)-2-Azetidinecarboxylic acid2517-04-6 4-Hydroxy-2-pyrrolidinone25747-41-5 3-Azetidinecarboxylic acid36476-78-5

Elsewhere

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