Name: Name:5-fluoro-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01BBC4
Rating: 90 (10 reviews)

5-fluoro-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

CAS No.:

1694276-99-7

Catalog Number:

AG01BBC4

Molecular Formula:

C7H9FN2O2

Molecular Weight:

172.1570

Catalog Number:

AG01BBC4

Chemical Name:

5-fluoro-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

CAS Number:

1694276-99-7

Molecular Formula:

C7H9FN2O2

Molecular Weight:

172.1570

MDL Number:

MFCD28505948

IUPAC Name:

5-fluoro-1-propan-2-ylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C7H9FN2O2/c1-4(2)10-6(8)5(3-9-10)7(11)12/h3-4H,1-2H3,(H,11,12)

InChI Key:

MCWWNHCOEUXJLJ-UHFFFAOYSA-N

SMILES:

CC(n1ncc(c1F)C(=O)O)C

Complexity:

186

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.159g/mol

Monoisotopic Mass:

172.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9