(5-phenyl-1,3,4-oxadiazol-2-yl)methanol

(5-phenyl-1,3,4-oxadiazol-2-yl)methanol

CAS: 54014-02-7

Formula: C9H8N2O2

SMILES: OCC1=NN=C(O1)C1=CC=CC=C1

IUPAC: (5-phenyl-1,3,4-oxadiazol-2-yl)methanol

InChI: InChI=1S/C9H8N2O2/c12-6-8-10-11-9(13-8)7-4-2-1-3-5-7/h1-5,12H,6H2

Composition: C (61.36%), H (4.58%), N (15.90%), O (18.16%)

Molar Mass: 176.175

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	176.058577506
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PZJYBNBHJONRLK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.23
Topological Polar Surface Area	59.15
Polarizability	18.18
Ring Count	2
Rotatable Bond Count	2

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