Name: Name:3-(4-Chloro-3-methyl-1H-pyrazol-1-yl)propanoic acid
Brand: Angene
SKU: AG00AK6R
Rating: 90 (10 reviews)

3-(4-Chloro-3-methyl-1H-pyrazol-1-yl)propanoic acid

CAS No.:

180741-32-6

Catalog Number:

AG00AK6R

Molecular Formula:

C7H9ClN2O2

Molecular Weight:

188.6116

Catalog Number:

AG00AK6R

Chemical Name:

3-(4-Chloro-3-methyl-1H-pyrazol-1-yl)propanoic acid

CAS Number:

180741-32-6

Molecular Formula:

C7H9ClN2O2

Molecular Weight:

188.6116

MDL Number:

MFCD03419612

IUPAC Name:

3-(4-chloro-3-methylpyrazol-1-yl)propanoic acid

InChI:

InChI=1S/C7H9ClN2O2/c1-5-6(8)4-10(9-5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12)

InChI Key:

NJCZETDQHHEDMD-UHFFFAOYSA-N

SMILES:

OC(=O)CCn1cc(c(n1)C)Cl

Complexity:

177

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

188.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

188.611g/mol

Monoisotopic Mass:

188.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7