Name: Name:2-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]acetic acid
Brand: Angene
SKU: AG019S3D
Rating: 90 (10 reviews)

2-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]acetic acid

CAS No.:

1354949-82-8

Catalog Number:

AG019S3D

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

Catalog Number:

AG019S3D

Chemical Name:

2-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]acetic acid

CAS Number:

1354949-82-8

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

MDL Number:

MFCD11099406

IUPAC Name:

2-[1-(4-fluorophenyl)pyrazol-3-yl]acetic acid

InChI:

InChI=1S/C11H9FN2O2/c12-8-1-3-10(4-2-8)14-6-5-9(13-14)7-11(15)16/h1-6H,7H2,(H,15,16)

InChI Key:

KKIHTCNLUMKUPY-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1ccn(n1)c1ccc(cc1)F

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.203g/mol

Monoisotopic Mass:

220.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5