2-[2-(2,5-dimethylphenyl)ethenyl]-5-methyl-1,3,4-oxadiazole

2-[2-(2,5-dimethylphenyl)ethenyl]-5-methyl-1,3,4-oxadiazole

CAS: 477856-53-4

Formula: C13H14N2O

SMILES: CC1=NN=C(O1)C=CC1=C(C)C=CC(C)=C1

IUPAC: 2-[2-(2,5-dimethylphenyl)ethenyl]-5-methyl-1,3,4-oxadiazole

InChI: InChI=1S/C13H14N2O/c1-9-4-5-10(2)12(8-9)6-7-13-15-14-11(3)16-13/h4-8H,1-3H3

Composition: C (72.87%), H (6.59%), N (13.07%), O (7.47%)

Molar Mass: 214.268

Atom Count: 30

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	214.110613079
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	GGCZSMIOTPBZPY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.36
Topological Polar Surface Area	38.92
Polarizability	23.76
Ring Count	2
Rotatable Bond Count	2

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