propyl 3,4,5-trihydroxybenzoate


Chemical Name: propyl 3,4,5-trihydroxybenzoate
CAS Number: 121-79-9
Product Number: AG003TZW(AGN-PC-0D62TE)
Synonyms:
MDL No:
Molecular Formula: C10H12O5
Molecular Weight: 212.1993

Identification/Properties


Properties
MP:
146-149 °C
BP:
448.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
212.201g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
212.068g/mol
Monoisotopic Mass:
212.068g/mol
Topological Polar Surface Area:
87A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
206
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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