5-(4-propoxyphenoxymethyl)-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

5-(4-propoxyphenoxymethyl)-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

CAS: 860784-36-7

Formula: C19H17F3N2O3

SMILES: CCCOC1=CC=C(OCC2=NC(=NO2)C2=CC=CC(=C2)C(F)(F)F)C=C1

IUPAC: 5-[(4-propoxyphenoxy)methyl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

InChI: InChI=1S/C19H17F3N2O3/c1-2-10-25-15-6-8-16(9-7-15)26-12-17-23-18(24-27-17)13-4-3-5-14(11-13)19(20,21)22/h3-9,11H,2,10,12H2,1H3

Composition: C (60.32%), H (4.53%), F (15.06%), N (7.40%), O (12.69%)

Molar Mass: 378.351

Atom Count: 44

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	378.119126904
Formal Charge	0
FSP3	0.26
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	LWQDSVKHRUMCNM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	104.2
Topological Polar Surface Area	57.38
Polarizability	35.1
Ring Count	3
Rotatable Bond Count	8

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