Name: Name:4-chloro-3-cyclopropyl-1H-pyrazole-5-carboxylic acid
Brand: Angene
SKU: AG019Z6T
Rating: 90 (10 reviews)

4-chloro-3-cyclopropyl-1H-pyrazole-5-carboxylic acid

CAS No.:

1867157-17-2

Catalog Number:

AG019Z6T

Molecular Formula:

C7H7ClN2O2

Molecular Weight:

186.5957

Catalog Number:

AG019Z6T

Chemical Name:

4-chloro-3-cyclopropyl-1H-pyrazole-5-carboxylic acid

CAS Number:

1867157-17-2

Molecular Formula:

C7H7ClN2O2

Molecular Weight:

186.5957

MDL Number:

MFCD17193935

IUPAC Name:

4-chloro-5-cyclopropyl-1H-pyrazole-3-carboxylic acid

InChI:

InChI=1S/C7H7ClN2O2/c8-4-5(3-1-2-3)9-10-6(4)7(11)12/h3H,1-2H2,(H,9,10)(H,11,12)

InChI Key:

NEZDRXPJTCMNCA-UHFFFAOYSA-N

SMILES:

OC(=O)c1[nH]nc(c1Cl)C1CC1

Complexity:

208

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

186.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

186.595g/mol

Monoisotopic Mass:

186.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3