Name: Name:4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG00E7RA
Rating: 90 (10 reviews)

4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxylic acid

CAS No.:

514800-80-7

Catalog Number:

AG00E7RA

Molecular Formula:

C6H7ClN2O2

Molecular Weight:

174.5850

Catalog Number:

AG00E7RA

Chemical Name:

4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxylic acid

CAS Number:

514800-80-7

Molecular Formula:

C6H7ClN2O2

Molecular Weight:

174.5850

MDL Number:

MFCD02253705

IUPAC Name:

4-chloro-1,5-dimethylpyrazole-3-carboxylic acid

InChI:

InChI=1S/C6H7ClN2O2/c1-3-4(7)5(6(10)11)8-9(3)2/h1-2H3,(H,10,11)

InChI Key:

MBPORVLOAPWZHK-UHFFFAOYSA-N

SMILES:

OC(=O)c1nn(c(c1Cl)C)C

Complexity:

176

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

174.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

174.584g/mol

Monoisotopic Mass:

174.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1