N-Acetylmorpholine

C₆H₁₁NO₂CAS 1696-20-4129.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₁₁NO₂
Molar mass: 129.16 g/mol
Exact mass: 129.0790 Da
Density: 1.1162 g/mL (at 20 °C)
Melting point: 14.5 °C
Boiling point: 89 °C (at 1 Torr)
logP: -0.13Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation51% of notifiers
H317 May cause an allergic skin reaction98.3% of notifiers
H319 Causes serious eye irritation51.3% of notifiers
H361 Suspected of damaging fertility or the unborn child98.3% of notifiers

Aggregated from 357 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P318, P321, P332+P317, P333+P317, P337+P317, P362+P364, P405, P501

Identifiers

CAS number

1696-20-4

SMILES

CC(=O)N1CCOCC1

InChIKey

KYWXRBNOYGGPIZ-UHFFFAOYSA-N

InChI

InChI=1S/C6H11NO2/c1-6(8)7-2-4-9-5-3-7/h2-5H2,1H3

Weigh it out

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

Names and synonyms

10 names

Ethanone, 1-(4-morpholinyl)-
Morpholine, 4-acetyl-
1-(4-Morpholinyl)ethanone
4-Acetylmorpholine
Acetomorpholide
NSC 2764
1-(Morpholin-4-yl)ethanone
1-Morpholinoethanone
1-Morpholinoethan-1-one
1-(Morpholin-4-yl)ethan-1-one

Work with N-Acetylmorpholine

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

N-Acetylpyrrolidine4030-18-661 % similar 1-Acetylpiperidine618-42-858 % similar 1-Acetylpiperazine13889-98-054 % similar 1-Acetyl-4-piperidone32161-06-154 % similar 1-(4-Aminopiperidin-1-yl)ethan-1-one160357-94-848 % similar 1-Acetylpiperidin-4-ol4045-22-148 % similar 4-Morpholinecarbonyl chloride15159-40-748 % similar N,N-Diethylacetamide685-91-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

L-Cyclopropylalanine102735-53-5 D-Cyclopropylalanine121786-39-8 4,4-Dimethoxybutanenitrile14618-78-1 (4S)-(-)-4-Isopropyl-2-oxazolidinone17016-83-0 (+)-Pipecolic acid1723-00-8 Dimethylacetoacetamide2044-64-6 (-)-Nipecotic acid25137-00-2 3-Methoxy-2-piperidone25219-59-4

Elsewhere

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