Home Other Building Blocks 4-(3-ethyl-1,2,4-oxadiazol-5-yl)butanoic acid

4-(3-ethyl-1,2,4-oxadiazol-5-yl)butanoic acid

CAS No.:
1038375-62-0
Catalog Number:
AG019N2J
Molecular Formula:
C8H12N2O3
Molecular Weight:
184.1925
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Product Description
Catalog Number:
AG019N2J
Chemical Name:
4-(3-ethyl-1,2,4-oxadiazol-5-yl)butanoic acid
CAS Number:
1038375-62-0
Molecular Formula:
C8H12N2O3
Molecular Weight:
184.1925
MDL Number:
MFCD12087067
IUPAC Name:
4-(3-ethyl-1,2,4-oxadiazol-5-yl)butanoic acid
InChI:
InChI=1S/C8H12N2O3/c1-2-6-9-7(13-10-6)4-3-5-8(11)12/h2-5H2,1H3,(H,11,12)
InChI Key:
XJGAWYPJAQTIGM-UHFFFAOYSA-N
SMILES:
CCc1nc(on1)CCCC(=O)O
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.195g/mol
Monoisotopic Mass:
184.085g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties