2,5-Diphenyl-1,3,4-oxadiazole

C₁₄H₁₀N₂OCAS 725-12-2222.25 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₀N₂O
Molar mass: 222.25 g/mol
Exact mass: 222.0793 Da
Melting point: 138 °C
Boiling point: 248 °C (at 16 Torr)
logP: 3.40Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed100% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number

725-12-2

SMILES

c1ccc(-c2nnc(-c3ccccc3)o2)cc1

InChIKey

DCJKUXYSYJBBRD-UHFFFAOYSA-N

InChI

InChI=1S/C14H10N2O/c1-3-7-11(8-4-1)13-15-16-14(17-13)12-9-5-2-6-10-12/h1-10H

Weigh it out

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

Names and synonyms

6 names

1,3,4-Oxadiazole, 2-5-diphenyl-
1,3,4-Oxadiazole, 2,5-diphenyl-
PPD
2,5-Diphenyloxadiazole
PPD (scintillator)
NSC 53152

Work with 2,5-Diphenyl-1,3,4-oxadiazole

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-(4-Biphenylyl)-5-phenyl-1,3,4-oxadiazole852-38-089 % similar 5-Phenyl-1,3,4-oxadiazole-2-thiol3004-42-067 % similar Butyl pbd15082-28-761 % similar 4,4'-(1,3,4-Oxadiazole-2,5-diyl)dianiline2425-95-854 % similar 2,5-Diphenyloxazole92-71-750 % similar 1,3-Bis(2-(4-tert-butylphenyl)-1,3,4-oxadiazo-5-yl)benzene138372-67-548 % similar POPOP1806-34-448 % similar 2-Phenylbenzoxazole833-50-148 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Azibenzil3469-17-8 3-Formyl-2-phenylimidazo[1,2-a]pyridine3672-39-7 4-Phenyl-1(2H)-phthalazinone5004-45-5

Elsewhere

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