Computed Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Synonyms
1-Benzyl-3-methyl-1H-pyrazole-5-carboxylic acid
1141-70-4
CTK0H8484
DTXSID00150655
KS-00001PL9
ZINC6070175
4666AH
MFCD01693537
AKOS022541212
KS-9062
LS-128284
2-benzyl-5-methylpyrazole-3-carboxylic acid
BRN 0200280
A-8248
J-003057
1-Benzyl-3-methyl-1H-pyrazole-5-carboxylic acid, 97%
1H-Pyrazole-5-carboxylic acid, 3-methyl-1-(phenylmethyl)-
C12H12N2O2
CID121029
C12-H12-N2-O2
Pyrazole-5-carboxylic acid, 1-benzyl-3-methyl-
1-Benzyl-3-methylpyrazole-5-carboxylic acid
1H-Pyrazole-5-carboxylicacid, 3-methyl-1-(phenylmethyl)-
AC1L3RYM
1-Benzyl-3-methyl-5-pyrazolecarboxylic acid
5-25-04-00121 (Beilstein Handbook Reference)
SCHEMBL5178107
