methyl 4-(3-ethyl-1,2,4-oxadiazol-5-yl)benzoate

methyl 4-(3-ethyl-1,2,4-oxadiazol-5-yl)benzoate

CAS: 1421261-37-1

Formula: C12H12N2O3

SMILES: CCC1=NOC(=N1)C1=CC=C(C=C1)C(=O)OC

IUPAC: methyl 4-(3-ethyl-1,2,4-oxadiazol-5-yl)benzoate

InChI: InChI=1S/C12H12N2O3/c1-3-10-13-11(17-14-10)8-4-6-9(7-5-8)12(15)16-2/h4-7H,3H2,1-2H3

Composition: C (62.06%), H (5.21%), N (12.06%), O (20.67%)

Molar Mass: 232.239

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	232.084792254
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ZEDYJJCOGRSZFM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.05
Topological Polar Surface Area	65.22
Polarizability	23.76
Ring Count	2
Rotatable Bond Count	4

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	1421261-37-1		$51.35-$86.31$51.35$63.37$86.31