Name: Name:1-(butan-2-yl)-5-cyclopropyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01A37X
Rating: 90 (10 reviews)

1-(butan-2-yl)-5-cyclopropyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1250391-52-6

Catalog Number:

AG01A37X

Molecular Formula:

C11H16N2O2

Molecular Weight:

208.2569

Catalog Number:

AG01A37X

Chemical Name:

1-(butan-2-yl)-5-cyclopropyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1250391-52-6

Molecular Formula:

C11H16N2O2

Molecular Weight:

208.2569

MDL Number:

MFCD14609726

IUPAC Name:

1-butan-2-yl-5-cyclopropylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C11H16N2O2/c1-3-7(2)13-10(8-4-5-8)9(6-12-13)11(14)15/h6-8H,3-5H2,1-2H3,(H,14,15)

InChI Key:

AQLPNAWLKPYKSU-UHFFFAOYSA-N

SMILES:

CCC(n1ncc(c1C1CC1)C(=O)O)C

Complexity:

253

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.261g/mol

Monoisotopic Mass:

208.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6