1,3-Benzenedicarboxylic acid, 5-hydroxy-


Chemical Name: 1,3-Benzenedicarboxylic acid, 5-hydroxy-
CAS Number: 618-83-7
Product Number: AG003MSO(AGN-PC-0JL8WR)
Synonyms:
MDL No:
Molecular Formula: C8H6O5
Molecular Weight: 182.1302

Identification/Properties


Properties
MP:
298-302 °C(lit.);
BP:
516.9°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.4330 (estimate)
Solubility:
0.6g/l
Computed Properties
Molecular Weight:
182.131g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
182.022g/mol
Monoisotopic Mass:
182.022g/mol
Topological Polar Surface Area:
94.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
203
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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