4-(4-chloro-3-methoxycarbonylphenyl)benzoic acid


Chemical Name: 4-(4-chloro-3-methoxycarbonylphenyl)benzoic acid
CAS Number: 1261998-46-2
Product Number: AG000SB7(AGN-PC-09Q0HY)
Synonyms:
MDL No:
Molecular Formula: C15H10ClO4-
Molecular Weight: 289.6905

Identification/Properties


Computed Properties
Molecular Weight:
290.699g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
290.035g/mol
Monoisotopic Mass:
290.035g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
363
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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