[1,1'-Biphenyl]-3-carboxylic acid, 4'-cyano-, methyl ester


Chemical Name: [1,1'-Biphenyl]-3-carboxylic acid, 4'-cyano-, methyl ester
CAS Number: 149505-91-9
Product Number: AG001LRB(AGN-PC-0LF7R6)
Synonyms:
MDL No:
Molecular Formula: C15H11NO2
Molecular Weight: 237.2533

Identification/Properties


Computed Properties
Molecular Weight:
237.258g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
237.079g/mol
Monoisotopic Mass:
237.079g/mol
Topological Polar Surface Area:
50.1A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
336
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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