4-(2-chloro-4-methylphenyl)-3-fluorobenzoic acid


Chemical Name: 4-(2-chloro-4-methylphenyl)-3-fluorobenzoic acid
CAS Number: 1262008-90-1
Product Number: AG000SBW(AGN-PC-09O0KL)
Synonyms:
MDL No:
Molecular Formula: C14H10ClFO2
Molecular Weight: 264.6794

Identification/Properties


Computed Properties
Molecular Weight:
264.68g/mol
XLogP3:
4.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
264.035g/mol
Monoisotopic Mass:
264.035g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
310
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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