2',6'-Dimethylbiphenyl-3-carboxylic acid


Chemical Name: 2',6'-Dimethylbiphenyl-3-carboxylic acid
CAS Number: 955929-56-3
Product Number: AG00IJ7I(AGN-PC-0WA5TI)
Synonyms:
MDL No:
Molecular Formula: C15H14O2
Molecular Weight: 226.2705

Identification/Properties


Computed Properties
Molecular Weight:
226.275g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
226.099g/mol
Monoisotopic Mass:
226.099g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
264
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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