Name: Name:3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoic acid
Brand: Angene
SKU: AG019N2N
Rating: 90 (10 reviews)

3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoic acid

CAS No.:

874815-89-1

Catalog Number:

AG019N2N

Molecular Formula:

C9H14N2O3

Molecular Weight:

198.2191

Catalog Number:

AG019N2N

Chemical Name:

3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoic acid

CAS Number:

874815-89-1

Molecular Formula:

C9H14N2O3

Molecular Weight:

198.2191

MDL Number:

MFCD06408966

IUPAC Name:

3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoic acid

InChI:

InChI=1S/C9H14N2O3/c1-9(2,3)8-10-6(14-11-8)4-5-7(12)13/h4-5H2,1-3H3,(H,12,13)

InChI Key:

VKXWNDWYGSUDQN-UHFFFAOYSA-N

SMILES:

OC(=O)CCc1onc(n1)C(C)(C)C

Complexity:

213

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.222g/mol

Monoisotopic Mass:

198.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6