chempirical

2-Morpholinobenzaldehyde

C11H13NO2CAS 58028-76-5191.23 g/mol

Open in Covalent MOL file
ONO
AldehydeEtherTertiary amine

Properties

Molecular formula
C11H13NO2
Molar mass
191.23 g/mol
Exact mass
191.0946 Da
logP
1.34Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
58028-76-5
SMILES
C1COCCN1C2=CC=CC=C2C=O
InChIKey
GTTAEWVBVHSDLX-UHFFFAOYSA-N
InChI
InChI=1S/C11H13NO2/c13-9-10-3-1-2-4-11(10)12-5-7-14-8-6-12/h1-4,9H,5-8H2

Weigh it out

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Work with 2-Morpholinobenzaldehyde

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

2-(Piperidin-1-yl)benzaldehyde34595-26-169 % similar 2-(1-Piperazinyl)benzaldehyde736991-52-965 % similar 2-(4-Methylpiperazino)benzaldehyde85803-62-963 % similar 2-(4-Benzylpiperazin-1-yl)benzaldehyde112253-26-658 % similar 2-Morpholinoaniline5585-33-151 % similar 3-(4-Morpholinyl)benzaldehyde446866-87-149 % similar 2-Morpholinobenzoic acid42106-48-948 % similar 4-Phenylmorpholine92-53-545 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(1,2,3,4-Tetrahydro-isoquinolin-1-yl)-acetic acid105400-81-5 (3R)-3-Phenyl-L-proline118758-48-8 4-Morpholinobenzaldehyde1204-86-0 4-Formyl-N-(1-methylethyl)benzamide13255-50-0 4-(Dimethylamino)cinnamic acid1552-96-1 4-(1-Pyrrolidinyl)benzoic acid22090-27-3 N-(4-Methylphenyl)-3-oxobutanamide2415-85-2 (R)-2-Amino-5-phenylpent-4-enoic acid264903-53-9

Elsewhere

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