chempirical

2-Methylnaphth[2,3-D]oxazole

C12H9NOCAS 20686-66-2183.21 g/mol

Open in Covalent MOL file
NO

Properties

Molecular formula
C12H9NO
Molar mass
183.21 g/mol
Exact mass
183.0684 Da
logP
3.29Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
20686-66-2
SMILES
Cc1nc2cc3ccccc3cc2o1
InChIKey
WMIHEWJRNFUVNR-UHFFFAOYSA-N
InChI
InChI=1S/C12H9NO/c1-8-13-11-6-9-4-2-3-5-10(9)7-12(11)14-8/h2-7H,1H3

Weigh it out

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

Names and synonyms

4 names
  • Naphth[2,3-d]oxazole, 2-methyl-
  • 2-Methylnaphtho[2,3-d]oxazole
  • 2-Methylnaphtho[2,3-d][1,3]oxazole
  • 2-Methylbenzo[f][1,3]benzoxazole

Work with 2-Methylnaphth[2,3-D]oxazole

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-Methylbenzoxazole95-21-660 % similar 2,5,6-Trimethylbenzoxazole19219-98-858 % similar 2-Methyl-5-phenylbenzoxazole61931-68-857 % similar 2,5-Dimethylbenzoxazole5676-58-455 % similar 5-Chloro-2-methylbenzoxazole19219-99-951 % similar 2-Methylnaphth[1,2-D]oxazole85-15-450 % similar 5-Chloro-2-methyl-6-benzoxazolamine323579-00-647 % similar 2-Methyl-6-nitrobenzoxazole5683-43-244 % similar

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

Same formula

4-(Pyridin-3-yl)benzaldehyde127406-55-7 4-(2-Pyridinyl)benzaldehyde127406-56-8 Phenoxazine135-67-1 4-Benzoylpyridine14548-46-0 2-(4-Pyridinyl)benzaldehyde176526-00-4 3-Dibenzofuranamine4106-66-5 1-Dibenzofuranamine50548-40-8 4-Dibenzofuranamine50548-43-1

Elsewhere

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