2-Propen-1-one,1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl]-3-(4-hydroxyphenyl)-, (2E)-


Chemical Name: 2-Propen-1-one,1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl]-3-(4-hydroxyphenyl)-, (2E)-
CAS Number: 6754-58-1
Product Number: AG003CSU(AGN-PC-0TORGA)
Synonyms:
MDL No:
Molecular Formula: C21H22O5
Molecular Weight: 354.3964

Identification/Properties


Properties
MP:
157-159℃
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Solubility:
ethanol: soluble10mg/mL
Computed Properties
Molecular Weight:
354.402g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
354.147g/mol
Monoisotopic Mass:
354.147g/mol
Topological Polar Surface Area:
87A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
515
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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