1,3-Benzenedicarboxylic acid, 4,6-dihydroxy-


Chemical Name: 1,3-Benzenedicarboxylic acid, 4,6-dihydroxy-
CAS Number: 19829-74-4
Product Number: AG002BEZ(AGN-PC-00AN53)
Synonyms:
MDL No: MFCD08693472
Molecular Formula: C8H6O6
Molecular Weight: 198.1296

Identification/Properties


Properties
MP:
308-310℃
BP:
551.0±35.0°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
198.13g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
198.016g/mol
Monoisotopic Mass:
198.016g/mol
Topological Polar Surface Area:
115A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
226
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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