2-[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]phenol

2-[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]phenol

CAS: 111997-58-1

Formula: C14H9BrN2O2

SMILES: OC1=C(C=CC=C1)C1=NN=C(O1)C1=CC=C(Br)C=C1

IUPAC: 2-[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]phenol

InChI: InChI=1S/C14H9BrN2O2/c15-10-7-5-9(6-8-10)13-16-17-14(19-13)11-3-1-2-4-12(11)18/h1-8,18H

Composition: C (53.02%), H (2.86%), Br (25.20%), N (8.83%), O (10.09%)

Molar Mass: 317.142

Atom Count: 28

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	315.984741
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YQRNZLAWINEMKI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.79
Topological Polar Surface Area	59.15
Polarizability	29.33
Ring Count	3
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	111997-58-1		$116.58-$390.37$116.58$134.76$390.37