6-Methylquinoxaline

C9H8N2CAS 6344-72-5144.18 g/mol

Open in Covalent MOL file
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Properties

Molecular formula
C9H8N2
Molar mass
144.18 g/mol
Exact mass
144.0687 Da
logP
1.94Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 6 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
6344-72-5
SMILES
CC1=CC2=NC=CN=C2C=C1
InChIKey
OSRARURJYPOUOV-UHFFFAOYSA-N
InChI
InChI=1S/C9H8N2/c1-7-2-3-8-9(6-7)11-5-4-10-8/h2-6H,1H3

Weigh it out

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

Work with 6-Methylquinoxaline

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

7-Methylquinoline612-60-257 % similar 6-Methylquinoline91-62-357 % similar 2,3,6-Trimethylquinoxaline17635-21-152 % similar 4-Chloro-6-methylquinoline18436-71-052 % similar 6-Bromoquinoxaline50998-17-948 % similar 6-Chloroquinoxaline5448-43-148 % similar 6-Aminoquinoxaline6298-37-948 % similar 5-Methylbenzoxazole10531-78-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Aminoisoquinoline1125-60-6 1-Phenylpyrazole1126-00-7 7-Indolinecarbonitrile115661-82-0 5-Methylquinoxaline13708-12-8 1-Isoquinolinamine1532-84-9 2-Methyl-[1,8]naphthyridine1569-16-0 4-Isoquinolinamine23687-25-4 6-Aminoisoquinoline23687-26-5

Elsewhere

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