AG002Z5J

29700-22-9 | 1,3-Benzenediol, 4-[(1E)-2-(3,5-dihydroxyphenyl)ethenyl]-

AG002Z5J

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CAS Number	29700-22-9
Catalog Number	AG002Z5J(AGN-PC-0O8OUO)
Chemical Name	1,3-Benzenediol, 4-[(1E)-2-(3,5-dihydroxyphenyl)ethenyl]-
IUPAC Name	4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,3-diol
InChI	InChI=1S/C14H12O4/c15-11-4-3-10(14(18)8-11)2-1-9-5-12(16)7-13(17)6-9/h1-8,15-18H/b2-1+
InChI Key	PDHAOJSHSJQANO-OWOJBTEDSA-N
MDL Number	MFCD11974969
Molecular Formula	C14H12O4
Molecular Weight	244.2427
NSC Number	315550
SMILES	OC1=CC=C(/C=C/C2=CC(O)=CC(O)=C2)C(O)=C1
UNII	6V071CP5CR
Synonyms	2,4,3',5'-tetrahydroxystilbene, oxyresveratrol, puag-haad, Oxyresveratrol, 29700-22-9, Tetrahydroxystilbene, (E)-4-(3,5-Dihydroxystyryl)benzene-1,3-diol, UNII-6V071CP5CR, trans-oxyresveratrol, 4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,3-diol, OXYLRESVERATROL, 4-[2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,3-diol, CHEMBL43065, 6V071CP5CR, CHEBI:7870, 1,3-Benzenediol, 4-[(1E)-2-(3,5-dihydroxyphenyl)ethenyl]-, J-501984, 4-[(E)-2-(3,5-dihydroxyphenyl)vinyl]benzene-1,3-diol, 2,3',4,5'-Tetrahydroxystilbene, Puag-haad, 4721-07-7, Oxyresveratrol A, 2,4,3',5'-Tetrahydroxystilbene, AK158555, AC1NQYYG, AC1Q7AZZ, MLS002473086, SCHEMBL501690, 3' 4 5'-tetrahydroxystilbene, MEGxp0_001057, REGID_for_CID_658108, ACon1_001063, cid_5281717, PDHAOJSHSJQANO-OWOJBTEDSA-N, REGID_for_CID_5281717, HMS2218H19, ZINC899161, 1,3-Benzenediol, 4-(2-(3,5-dihydroxyphenyl)ethenyl)-, (E)-, BCP24308, EBD28985, HY-N1430, ABP001078, BDBM50108046, LMPK13090011, MFCD11974969, NSC315550, s4739, Oxyresveratrol, >=97.0% (HPLC), AKOS015915071, AC-5279, CS-5655, MCULE-6461324045, NSC 315550, NSC-315550, trans-2',3,4',5-Tetramethoxystilbene, trans-2,3',4,5'-tetrahydroxystilbene, trans-2,4,3',5'-tetrahydroxystilbene, 2,3',4,5'-Tetrahydroxy-trans-stilbene, NCGC00169713-01, AJ-24286, AN-11169, AS-35032, SMR001397189, trans-2,4,3'',5''-tetrahydroxystilbene, AB0072945, AX8161461, N.357, O0373, ST24035060, C10273, 700O229, A820013, I14-6892, (E)-5,5'-(ethene-1,2-diyl)bis(benzene-1,3-diol), 1,3-Benzenediol, 4-(2-(3,5-dihydroxyphenyl)ethenyl)-, 4-[(1E)-2-(3,5-Dihydroxyphenyl)ethenyl]-1,3-benzenediol, 4-[(E)-2-[3,5-bis(oxidanyl)phenyl]ethenyl]benzene-1,3-diol, (oxyresveratrol)4-[(E)-2-(3,5-dihydroxyphenyl)vinyl]benzene-1,3-diol, (E)-2,3 inverted exclamation marka,4,5 inverted exclamation marka-Stilbenetetrol, 2,3 inverted exclamation marka,4,5 inverted exclamation marka-Tetrahydroxy-trans-stilbene, NCGC00169713-02!4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,3-diol, EZE, Hydroxyresveratrol, D06ZRX, 4-[2- ethenyl]benzene-1,3-diol, AR-1F9520, ACN-035711, C14-H12-O4, CID5281717, Oxyresveratrol, 98% - 100MG 100mg, C034912, 4982-02-9,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	244.074g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	244.246g/mol
Monoisotopic Mass	244.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	80.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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