Name: Name:2-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]acetic acid
Brand: Angene
SKU: AG01AL8A
Rating: 90 (10 reviews)

2-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]acetic acid

CAS No.:

1007502-38-6

Catalog Number:

AG01AL8A

Molecular Formula:

C10H16N2O2

Molecular Weight:

196.2462

Catalog Number:

AG01AL8A

Chemical Name:

2-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]acetic acid

CAS Number:

1007502-38-6

Molecular Formula:

C10H16N2O2

Molecular Weight:

196.2462

MDL Number:

MFCD08700827

IUPAC Name:

2-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)acetic acid

InChI:

InChI=1S/C10H16N2O2/c1-6(2)12-8(4)9(5-10(13)14)7(3)11-12/h6H,5H2,1-4H3,(H,13,14)

InChI Key:

ZERXEZOBCJYCJF-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1c(C)nn(c1C)C(C)C

Complexity:

218

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.25g/mol

Monoisotopic Mass:

196.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2