4-(4-tert-butylphenyl)-2-chlorobenzoic acid


Chemical Name: 4-(4-tert-butylphenyl)-2-chlorobenzoic acid
CAS Number: 1261955-02-5
Product Number: AG000S8Q(AGN-PC-09O0UK)
Synonyms:
MDL No:
Molecular Formula: C17H17ClO2
Molecular Weight: 288.7687

Identification/Properties


Computed Properties
Molecular Weight:
288.771g/mol
XLogP3:
5.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
288.092g/mol
Monoisotopic Mass:
288.092g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
339
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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