AG007DIE

33626-08-3 | (E)-5-(4-Methoxystyryl)benzene-1,3-diol

AG007DIE

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CAS Number	33626-08-3
Catalog Number	AG007DIE(AGN-PC-0O9213)
Chemical Name	(E)-5-(4-Methoxystyryl)benzene-1,3-diol
IUPAC Name	5-[(E)-2-(4-methoxyphenyl)ethenyl]benzene-1,3-diol
InChI	InChI=1S/C15H14O3/c1-18-15-6-4-11(5-7-15)2-3-12-8-13(16)10-14(17)9-12/h2-10,16-17H,1H3/b3-2+
InChI Key	IHVRWFJGOIWMGC-NSCUHMNNSA-N
MDL Number	MFCD12407152
Molecular Formula	C15H14O3
Molecular Weight	242.2699
SMILES	COC1=CC=C(C=C1)C=CC1=CC(O)=CC(O)=C1
Synonyms	4'-methoxyresveratrol, 33626-08-3, (E)-5-(4-Methoxystyryl)benzene-1,3-diol, 4'-Methoxyresveratrol, RESVERATROL 4'-METHYL ETHER, Desoxyrhapontigenin, CHEMBL291501, 1,3-Benzenediol, 5-[(1E)-2-(4-methoxyphenyl)ethenyl]-, Spectrum5_000570, BSPBio_003527, SCHEMBL563261, SCHEMBL563262, 4'-Methoxystilbene-3,5-diol, AC1O2O02, BML 233, BML-233, CHEBI:108593, IHVRWFJGOIWMGC-NSCUHMNNSA-N, 3,5-dihydroxy-4''-methoxystilbene, ZINC3978779, 3942AB, BDBM50085541, CCG-38350, MFCD12407152, 5-(4-methoxystyryl)benzene-1,3-diol, AKOS015915073, AC-7025, SDCCGMLS-0066773.P001, QTL1_000070, (E)-3,5-dihydroxy-4''-methoxystilbene, 13E-3,5-dihydroxy-4''-methoxystilbene, NCGC00094628-01, NCGC00094628-02, 3,5-dihydroxy-4'-methoxy-trans-stilbene, AJ-47573, AT-18606, BR-72821, DS-15252, trans-3,5-dihydroxy-4''-methoxystilbene, ST2402522, 4CH-018067, 626M083, SR-05000002490, 5-[2-(4-Methoxy-phenyl)-vinyl]-benzene-1,3-diol, I14-6894, SR-05000002490-1, 5-[(E)-2-(4-methoxyphenyl)ethenyl]benzene-1,3-diol, 5-[(E)-2-(4-methoxyphenyl)vinyl]benzene-1,3-diol, BRD-K02671211-001-02-2, BRD-K02671211-001-03-0, E 5-[2-(4-Methoxy-phenyl)-vinyl]-benzene-1,3-diol, 5-[(E)-2-(4-Methoxy-phenyl)-vinyl]-benzene-1,3-diol, 5-[2-((E)-4-Methoxy-phenyl)-vinyl]-benzene-1,3-diol, Deoxyrhapontigenin, 4/'-Methoxystilbene-3,5-diol, C15H14O3, ACN-057235, CID6255462,

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	242.094g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	242.274g/mol
Monoisotopic Mass	242.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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