Name: Name:5-oxo-1-(1H-pyrazol-4-yl)pyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG019TSQ
Rating: 90 (10 reviews)

5-oxo-1-(1H-pyrazol-4-yl)pyrrolidine-3-carboxylic acid

CAS No.:

1156167-68-8

Catalog Number:

AG019TSQ

Molecular Formula:

C8H9N3O3

Molecular Weight:

195.1754

Catalog Number:

AG019TSQ

Chemical Name:

5-oxo-1-(1H-pyrazol-4-yl)pyrrolidine-3-carboxylic acid

CAS Number:

1156167-68-8

Molecular Formula:

C8H9N3O3

Molecular Weight:

195.1754

MDL Number:

MFCD12133606

IUPAC Name:

5-oxo-1-(1H-pyrazol-4-yl)pyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C8H9N3O3/c12-7-1-5(8(13)14)4-11(7)6-2-9-10-3-6/h2-3,5H,1,4H2,(H,9,10)(H,13,14)

InChI Key:

OXTYWNUUIMVAGL-UHFFFAOYSA-N

SMILES:

OC(=O)C1CC(=O)N(C1)c1c[nH]nc1

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

195.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

195.178g/mol

Monoisotopic Mass:

195.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.2