2-chloro-5-phenyl-1,3,4-oxadiazole

2-chloro-5-phenyl-1,3,4-oxadiazole

CAS: 1483-31-4

Formula: C8H5ClN2O

SMILES: ClC1=NN=C(O1)C1=CC=CC=C1

IUPAC: 2-chloro-5-phenyl-1,3,4-oxadiazole

InChI: InChI=1S/C8H5ClN2O/c9-8-11-10-7(12-8)6-4-2-1-3-5-6/h1-5H

Composition: C (53.21%), H (2.79%), Cl (19.63%), N (15.51%), O (8.86%)

Molar Mass: 180.59

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	180.0090405
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	QSGNNXKJPIMRPO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.11
Topological Polar Surface Area	38.92
Polarizability	17.77
Ring Count	2
Rotatable Bond Count	1

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