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1404364-21-1 | 4-fluoro-5-(o-tolyl)-1H-pyrazole-3-carboxylic acid
CAS No: 1404364-21-1 Catalog No: AG01FFTX MDL No:
Product Description
Catalog Number:
AG01FFTX
Chemical Name:
4-fluoro-5-(o-tolyl)-1H-pyrazole-3-carboxylic acid
CAS Number:
1404364-21-1
IUPAC Name:
4-fluoro-3-(2-methylphenyl)-1H-pyrazole-5-carboxylic acid
InChI:
InChI=1S/C11H9FN2O2/c1-6-4-2-3-5-7(6)9-8(12)10(11(15)16)14-13-9/h2-5H,1H3,(H,13,14)(H,15,16)
InChI Key:
YHMSICLRWIBJFM-UHFFFAOYSA-N
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.065g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.203g/mol
Monoisotopic Mass:
220.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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