1,3-Benzenediol, 4-[(1E)-2-(3,5-dihydroxyphenyl)ethenyl]-


Chemical Name: 1,3-Benzenediol, 4-[(1E)-2-(3,5-dihydroxyphenyl)ethenyl]-
CAS Number: 29700-22-9
Product Number: AG002Z5J(AGN-PC-0O8OUO)
Synonyms:
MDL No:
Molecular Formula: C14H12O4
Molecular Weight: 244.2427

Identification/Properties


Properties
MP:
>172ºC (dec.)
BP:
523.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
244.246g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
244.074g/mol
Monoisotopic Mass:
244.074g/mol
Topological Polar Surface Area:
80.9A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
282
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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