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Dehydrodieugenol

PubChem CID: 165225

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Compound Synonyms Dehydrodieugenol, Dieugenol, 4433-08-3, Bis-Eugenol, 2,2'-Biphenyldiol, 5,5'-diallyl-3,3'-dimethoxy-, Benzonitrile, 4-hydroxy-3-methoxy-, CHEBI:4361, DTXSID80196137, 2-(2-hydroxy-3-methoxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol, 4-allyl-2-(5-allyl-2-hydroxy-3-methoxy-phenyl)-6-methoxy-phenol, [1,1'-Biphenyl]-2,2'-diol, 3,3'-dimethoxy-5,5'-di-2-propenyl-, 3,3'-dimethoxy-5,5'-di-2-propen-1-yl-[1,1'-biphenyl]-2,2'-diol, AC1L4WB6, AC1Q79LE, Bieugenol, (1,1'-Biphenyl)-2,2'-diol, 3,3'-dimethoxy-5,5'-di-2-propenyl-, Dehydro-di-eugenol, CHEMBL182629, SCHEMBL5320878, DTXCID90118628, EAA43308, HY-130743, CS-0112650, AB00115914-01, SR-01000500269, SR-01000500269-1, Q27106349, 5,5'-Diallyl-3,3'-dimethoxy[1,1'-biphenyl]-2,2'-diol #
Topological Polar Surface Area 58.9
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 24.0
Isotope Atom Count 0.0
Molecular Complexity 372.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 2-(2-hydroxy-3-methoxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol
Prediction Hob 1.0
Xlogp 4.9
Molecular Formula C20H22O4
Prediction Swissadme 0.0
Inchi Key KETPSFSOGFKJJY-UHFFFAOYSA-N
Fcsp3 0.2
Logs -5.171
Rotatable Bond Count 7.0
Logd 3.467
Compound Name Dehydrodieugenol
Prediction Hob Swissadme 0.0
Exact Mass 326.152
Formal Charge 0.0
Monoisotopic Mass 326.152
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 326.4
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -4.871230400000001
Inchi InChI=1S/C20H22O4/c1-5-7-13-9-15(19(21)17(11-13)23-3)16-10-14(8-6-2)12-18(24-4)20(16)22/h5-6,9-12,21-22H,1-2,7-8H2,3-4H3
Smiles COC1=CC(=CC(=C1O)C2=C(C(=CC(=C2)CC=C)OC)O)CC=C
Nring 2.0
Defined Bond Stereocenter Count 0.0