ChemicalBook--->CAS DataBase List--->19431-84-6

19431-84-6

19431-84-6 Structure

19431-84-6 Structure
IdentificationBack Directory
[Name]

Curcumenol
[CAS]

19431-84-6
[Synonyms]

oil of zedoary turmeric
6H-3a,6-Epoxyazulen-6-ol,1,2,3,4,5,8a-hexahydro-
3,8-dimethyl-5-(1-methylethylidene)-,(3S,3aS,6R,8aS)-
6H-3a,6-Epoxyazulen-6-ol, 1,2,3,4,5,8a-hexahydro-3,8-dimethyl-5-(1-methylethylidene)-, (3S,3aS,6R,8aS)-
(3S,3alphaS,6R,8alphaS)-1,2,3,4,5,8alpha-Hexahydro-3,8-dimethyl-5-(1-methylethylidene)-6H-3alpha,6-epoxyazulen-6-ol
[Molecular Formula]

C15H22O2
[MDL Number]

MFCD01729508
[MOL File]

19431-84-6.mol
[Molecular Weight]

234.33
Chemical PropertiesBack Directory
[Melting point ]

113-115 °C
[Boiling point ]

349.3±42.0 °C(Predicted)
[density ]

1.10
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
[form ]

Powder
[pka]

12.38±0.60(Predicted)
[color ]

White to off-white
[Odor]

at 100.00 %. fresh fatty
[Odor Type]

fatty
[InChI]

InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h7,11-12,16H,5-6,8H2,1-4H3/t11-,12-,14-,15+/m0/s1
[InChIKey]

ISFMXVMWEWLJGJ-NZBPQXDJSA-N
[SMILES]

C1[C@]2([H])[C@@]3(O[C@](O)(C=C2C)/C(=C(\C)/C)/C3)[C@@H](C)C1
[LogP]

3.141 (est)
Hazard InformationBack Directory
[Chemical Properties]

White needle-shaped crystals, soluble in organic solvents such as methanol, ethanol, and DMSO, derived from Curcuma zedoaria.
[Uses]

Curcumenol is used in methods and formulations for preventing downward migration of agricultural materials.
[IC 50]

CYP3
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

Curcumenol(19431-84-6)1HNMR
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