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728919-21-9,MFCD04117430
Catalog No.:AA003IFW
728919-21-9 | 3',4'-Dimethylbiphenyl-3-carboxylic acid
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100mg
1 week  
$290.00   $203.00
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Technical Information
Catalog Number:
AA003IFW
Chemical Name:
3',4'-Dimethylbiphenyl-3-carboxylic acid
CAS Number:
728919-21-9
MDL Number:
MFCD04117430
IUPAC Name:
3-(3,4-dimethylphenyl)benzoic acid
InChI:
InChI=1S/C15H14O2/c1-10-6-7-13(8-11(10)2)12-4-3-5-14(9-12)15(16)17/h3-9H,1-2H3,(H,16,17)
InChI Key:
QCNROSMDZFNPPB-UHFFFAOYSA-N
Properties
Computed Properties
 
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.099g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.275g/mol
Monoisotopic Mass:
226.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

Synonyms
 
728919-21-9 
3',4'-dimethylbiphenyl-3-carboxylic acid 
MFCD04117430 
AKOS002678676 
RTR-023742 
CC-13289 
3',4'-Dimethyl biphenyl-3-carboxylic acid 
BC1737592 
DB-021942 
FT-0644860 
C-12869 
CID2758546 
3',4'-Dimethyl-biphenyl-3-carboxylic acid 
3,4-Dimethylbiphenyl-3-carboxylic acid 
3-(3,4-dimethylphenyl)benzoic Acid 
3',4'-Dimethyl-[1,1'-biphenyl]-3-carboxylic acid 
[1,1'-Biphenyl]-3-carboxylicacid, 3',4'-dimethyl- 
AC1MBYEQ 
CTK2H8762 
ZINC2529001 
KM1520 
Literature
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