5-Acetyl-2-methoxypyridine

C8H9NO2CAS 213193-32-9151.16 g/mol

Open in Covalent MOL file
ONO
EtherKetone

Properties

Molecular formula
C8H9NO2
Molar mass
151.16 g/mol
Exact mass
151.0633 Da
logP
1.29Crippen estimate
Polar surface area
39.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
213193-32-9
SMILES
CC(=O)C1=CN=C(C=C1)OC
InChIKey
RYOQZXOVBJIUSX-UHFFFAOYSA-N
InChI
InChI=1S/C8H9NO2/c1-6(10)7-3-4-8(11-2)9-5-7/h3-5H,1-2H3

Weigh it out

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Names and synonyms

1 names
  • 5-Acetyl-2-methoxypyridine, 97%

Work with 5-Acetyl-2-methoxypyridine

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

Methyl 6-methoxynicotinate26218-80-463 % similar 6-Methoxynicotinic acid66572-55-263 % similar 1-(6-Methyl-3-pyridinyl)ethanone36357-38-756 % similar Acetanisole100-06-155 % similar 1-(6-Bromo-pyridin-3-yl)-ethanone139042-59-454 % similar 2-Chloro-5-acetylpyridine55676-22-754 % similar 1-[6-(Trifluoromethyl)pyridin-3-yl]ethanone358780-14-051 % similar 3,4-Dimethoxyacetophenone1131-62-050 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Ethyl-4-nitrobenzene100-12-9 N-Phenylglycine103-01-5 Acetaminophen103-90-2 4-(Methylamino)benzoic acid10541-83-0 N-Methylanthranilic acid119-68-6 4-Aminophenylacetic acid1197-55-3 2,6-Dimethyl-4-nitrosophenol13331-93-6 Methyl anthranilate134-20-3

Elsewhere

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