4-cyano-N-(3-methyl-1,2-oxazol-5-yl)benzamide

4-cyano-N-(3-methyl-1,2-oxazol-5-yl)benzamide

CAS: 866043-21-2

Formula: C12H9N3O2

SMILES: CC1=NOC(NC(=O)C2=CC=C(C=C2)C#N)=C1

IUPAC: 4-cyano-N-(3-methyl-1,2-oxazol-5-yl)benzamide

InChI: InChI=1S/C12H9N3O2/c1-8-6-11(17-15-8)14-12(16)10-4-2-9(7-13)3-5-10/h2-6H,1H3,(H,14,16)

Composition: C (63.43%), H (3.99%), N (18.49%), O (14.08%)

Molar Mass: 227.223

Atom Count: 26

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	227.069476542
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	GVXAIGQENUIKCO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.6
Topological Polar Surface Area	78.92
Polarizability	22.55
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	866043-21-2		$51.35-$86.31$51.35$63.37$86.31