Name: Name:4,4,4-trifluoro-3-(1H-pyrazol-1-yl)butanoic acid
Brand: Angene
SKU: AG01B50J
Rating: 90 (10 reviews)

4,4,4-trifluoro-3-(1H-pyrazol-1-yl)butanoic acid

CAS No.:

1343742-50-6

Catalog Number:

AG01B50J

Molecular Formula:

C7H7F3N2O2

Molecular Weight:

208.1379

Catalog Number:

AG01B50J

Chemical Name:

4,4,4-trifluoro-3-(1H-pyrazol-1-yl)butanoic acid

CAS Number:

1343742-50-6

Molecular Formula:

C7H7F3N2O2

Molecular Weight:

208.1379

MDL Number:

MFCD17287189

IUPAC Name:

4,4,4-trifluoro-3-pyrazol-1-ylbutanoic acid

InChI:

InChI=1S/C7H7F3N2O2/c8-7(9,10)5(4-6(13)14)12-3-1-2-11-12/h1-3,5H,4H2,(H,13,14)

InChI Key:

KMYZQFSKQZWVLP-UHFFFAOYSA-N

SMILES:

OC(=O)CC(C(F)(F)F)n1cccn1

Complexity:

220

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.14g/mol

Monoisotopic Mass:

208.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8