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

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

CAS: 23432-93-1

Formula: C8H5ClN2O

SMILES: ClC1=NOC(=N1)C1=CC=CC=C1

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

InChI: InChI=1S/C8H5ClN2O/c9-8-10-7(12-11-8)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	KQNDRQCJJPCDJO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.27
Topological Polar Surface Area	38.92
Polarizability	17.76
Ring Count	2
Rotatable Bond Count	1

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95%	<4 Days	23432-93-1		$105.80-$1,151.15$105.80$234.60$936.10$1,151.15