Name: Name:4-(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
Brand: Angene
SKU: AG019NAK
Rating: 90 (10 reviews)

4-(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

CAS No.:

1087784-74-4

Catalog Number:

AG019NAK

Molecular Formula:

C11H12N2O2

Molecular Weight:

204.2252

Catalog Number:

AG019NAK

Chemical Name:

4-(3-methyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

CAS Number:

1087784-74-4

Molecular Formula:

C11H12N2O2

Molecular Weight:

204.2252

MDL Number:

MFCD11505520

IUPAC Name:

4-(5-methyl-3,4-dihydropyrazol-2-yl)benzoic acid

InChI:

InChI=1S/C11H12N2O2/c1-8-6-7-13(12-8)10-4-2-9(3-5-10)11(14)15/h2-5H,6-7H2,1H3,(H,14,15)

InChI Key:

ZNSOPPVIOVDORC-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1)N1CCC(=N1)C

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.229g/mol

Monoisotopic Mass:

204.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4