Benzoic acid, 4-chloro-3-hydroxy-


Chemical Name: Benzoic acid, 4-chloro-3-hydroxy-
CAS Number: 34113-69-4
Product Number: AG003L4U(AGN-PC-0JMSA4)
Synonyms:
MDL No: MFCD00153892
Molecular Formula: C7H5ClO3
Molecular Weight: 172.5658

Identification/Properties


Properties
MP:
219.5 - 220.5 °C
BP:
457.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
172.564g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
171.993g/mol
Monoisotopic Mass:
171.993g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
160
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


NMR Spectrum


Other Analytical Data


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