Text Search
Structure Search

3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

CAS: 500026-39-1

Formula: C13H14N2O4

SMILES: CCOC1=CC=C(C=C1)C1=NOC(CCC(O)=O)=N1

IUPAC: 3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

InChI: InChI=1S/C13H14N2O4/c1-2-18-10-5-3-9(4-6-10)13-14-11(19-15-13)7-8-12(16)17/h3-6H,2,7-8H2,1H3,(H,16,17)

Composition: C (59.54%), H (5.38%), N (10.68%), O (24.40%)

Molar Mass: 262.265

Atom Count: 33

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 262.095356939
Formal Charge 0
FSP3 0.31
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey WKJJPENOGQVARC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 78.63
Topological Polar Surface Area 85.45
Polarizability 26.15
Ring Count 2
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
MATRIX SCIENTIFIC
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 500026-39-1 $269.51$269.51
Request Quote