Zingerone

  • Identifiers

    CAS mumber
    122-48-5

    Molecular formula
    C11H14O3

    SMILES
    CC(=O)CCC1=CC(=C(C=C1)O)OC

    Retention indicies (RI)

    • DB5: 1640.0

  • Properties

    XLogP3-AA
    0.8 Well soluble in MMB, TEC, DEP

    Molecular weight
    194.23 g/mol

    Melting points

    • 40.5 °C
    • 41 °C

    Boiling points

    • 187-188 °C @ 14 mm Hg
    • 141.00 to 0.50 °C. @ 0.00 mm Hg

    Flash points

    • APPROX 102 °C

    Solubilities

    • Sparingly sol in water, petroleum ether; sol in ether, dil alkalies
    • Very soluble in ethyl ether
    • SOLUBILITY 1:1 IN 50% ALCOHOL
    • slightly soluble in water
    • moderately soluble (in ethanol)

  • Synonyms

    • ZINGERONE
    • Vanillylacetone
    • 122-48-5
    • 4-(4-Hydroxy-3-methoxyphenyl)butan-2-one
    • Zingherone
    • Zingiberone
    • 4-(4-Hydroxy-3-methoxyphenyl)-2-butanone
    • Gingerone
    • Vanillyl acetone
    • 2-Butanone, 4-(4-hydroxy-3-methoxyphenyl)-
    • 4-Hydroxy-3-methoxybenzylacetone
    • [0]-Paradol
    • (4-Hydroxy-3-methoxyphenyl)ethyl methyl ketone
    • (0)-Paradol
    • 3-Methoxy-4-hydroxybenzylacetone
    • 4-(3-Methoxy-4-hydroxyphenyl)-2-butanone
    • FEMA No. 3124
    • (O)-Paradol
    • 3-Methoxy-4-hydroxy-benzylacetone
    • 2-(4-Hydroxy-3-methoxyphenyl)ethyl methyl ketone
    • NSC 15335
    • vanillylaceton
    • CCRIS 2036
    • UNII-4MMW850892
    • HSDB 1064
    • EINECS 204-548-3
    • [0]Paradol
    • BRN 2051099
    • DTXSID8047420
    • CHEBI:68657
    • AI3-31837
    • Vanillylacetone;Gingerone
    • ZINGERONE [FCC]
    • 4-(4-hydroxy-3-methoxy-phenyl)-butan-2-one
    • ZINGERONE [MI]
    • ZINGERONE [FHFI]
    • ZINGERONE [HSDB]
    • MFCD00048232
    • NSC-15335
    • 4MMW850892
    • CHEMBL25894
    • VANILLYLACETON [WHO-DD]
    • DTXCID6027420
    • FEMA 3124
    • 4-08-00-01866 (Beilstein Handbook Reference)
    • (0)Paradol
    • 4-(3-methoxy-4-hydroxyphenyl)butan-2-one
    • 4-(4-Hydroxy-3-methoxyphenyl)-2-butanone, 9CI, 8CI
    • 0 paradol
    • Zincbacitracin
    • Zingerone (Standard)
    • ZINGERONE [INCI]
    • 3Methoxy4hydroxybenzylacetone
    • 4Hydroxy3methoxybenzylacetone
    • SCHEMBL119051
    • Vanillylacetone, >=96%, FG
    • 4-(4-hydroxy-3-methoxyphenyl)-
    • HMS3651E22
    • 4(3Methoxy4hydroxyphenyl)2butanone
    • 4(4Hydroxy3methoxyphenyl)2butanone
    • NSC15335
    • Tox21_302493
    • BDBM50304073
    • HY-14621R
    • s2371
    • STL564783
    • 2Butanone, 4(4hydroxy3methoxyphenyl)
    • AKOS009462778
    • CCG-208511
    • DB15589
    • FV05929
    • Vanillylacetone, >=98%, natural, FG
    • Zingerone, analytical reference material
    • NCGC00256663-01
    • 1ST40217
    • AC-34331
    • AS-65368
    • CAS-122-48-5
    • HY-14621
    • SY017980
    • 4(4-Hydroxy-3-methoxyphenyl)-2-butanone
    • (4Hydroxy3methoxyphenyl)ethyl methyl ketone
    • DB-003808
    • 2(4Hydroxy3methoxyphenyl)ethyl methyl ketone
    • CS-0003480
    • H1314
    • NS00013332
    • SW219618-1
    • C17497
    • EN300-1721864
    • SR-05000013705
    • Q1064625
    • SR-05000013705-1
    • BRD-K33510429-001-02-3
    • BRD-K33510429-001-03-1
    • Z1255442373
    • 3-Methoxy-4-hydroxybenzylacetone;Zingerone;4-(3-methoxy-4-hydroxyphenyl)-2-butanone
1 3

Botanical

Name CAS Botanical Proportion
Ginger (China) 4 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.01%
Agarwood smoke 2 Aquilaria agallocha Roxb., fam. Thymelaeaceae 1.88%
Genet absolute 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.05%
Boronia megastigma 91771-36-7 Boronia megastigma Nees., fam. Rutaceae 0.05%
Ginger (Australia) 3 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.64%