Home Other Building Blocks 3-(3,5-Dimethyl-4-pyrazolyl)benzoic Acid

3-(3,5-Dimethyl-4-pyrazolyl)benzoic Acid

CAS No.:
1229025-67-5
Catalog Number:
AG01F28G
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01F28G
Chemical Name:
3-(3,5-Dimethyl-4-pyrazolyl)benzoic Acid
CAS Number:
1229025-67-5
MDL Number:
MFCD11916000
IUPAC Name:
3-(3,5-dimethyl-1H-pyrazol-4-yl)benzoic acid
InChI:
InChI=1S/C12H12N2O2/c1-7-11(8(2)14-13-7)9-4-3-5-10(6-9)12(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)
InChI Key:
JUMMUZIWYCEJRA-UHFFFAOYSA-N
Properties
Complexity:
270  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties