Name: Name:2-(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)acetic acid
Brand: Angene
SKU: AG01BIG3
Rating: 90 (10 reviews)

2-(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)acetic acid

CAS No.:

1480942-30-0

Catalog Number:

AG01BIG3

Molecular Formula:

C8H11ClN2O2

Molecular Weight:

202.6381

Catalog Number:

AG01BIG3

Chemical Name:

2-(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)acetic acid

CAS Number:

1480942-30-0

Molecular Formula:

C8H11ClN2O2

Molecular Weight:

202.6381

MDL Number:

MFCD21318147

IUPAC Name:

2-(4-chloro-5-ethyl-2-methylpyrazol-3-yl)acetic acid

InChI:

InChI=1S/C8H11ClN2O2/c1-3-5-8(9)6(4-7(12)13)11(2)10-5/h3-4H2,1-2H3,(H,12,13)

InChI Key:

SPIGVPPRVVQZMA-UHFFFAOYSA-N

SMILES:

CCc1nn(c(c1Cl)CC(=O)O)C

Complexity:

201

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

202.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

202.638g/mol

Monoisotopic Mass:

202.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2