chempirical

2-Methylnaphth[1,2-D]oxazole

C12H9NOCAS 85-15-4183.21 g/mol

Open in Covalent MOL file
NO

Properties

Molecular formula
C12H9NO
Molar mass
183.21 g/mol
Exact mass
183.0684 Da
Melting point
27 °C
Boiling point
312 °C
logP
3.29Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
85-15-4
SMILES
Cc1nc2c(ccc3ccccc32)o1
InChIKey
JCTNVNANPZAULC-UHFFFAOYSA-N
InChI
InChI=1S/C12H9NO/c1-8-13-12-10-5-3-2-4-9(10)6-7-11(12)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[1,2-d]oxazole, 2-methyl-
  • 2-Methyl-4,5-benzobenzoxazole
  • 2-Methylnaphtho[1,2-d]oxazole
  • 2-Methylnaphtho[1,2-d][1,3]oxazole

Work with 2-Methylnaphth[1,2-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Methylbenzoxazole95-21-647 % similar 2-Methylnaphtho[1,2-D]thiazole2682-45-344 % similar 2-Methyl-5-phenylbenzoxazole61931-68-843 % similar 2-Methyl-4H-3,1-benzoxazin-4-one525-76-841 % similar Benzo[H]quinoline230-27-340 % similar 2,5-Dimethylbenzoxazole5676-58-439 % similar Phenanthrene85-01-838 % similar 2,5,6-Trimethylbenzoxazole19219-98-838 % 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 3-(3-Pyridyl)benzaldehyde131231-24-8 Phenoxazine135-67-1 4-Benzoylpyridine14548-46-0 2-(4-Pyridinyl)benzaldehyde176526-00-4 2-Methylnaphth[2,3-D]oxazole20686-66-2 3-Dibenzofuranamine4106-66-5

Elsewhere

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