Deoxyelephantopin

Basic Information

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CAS Number

29307-03-7

Molecular Formula

C19H20O6

Molecular Weight

344.36 g/mol

Basic Physical Properties

Physical State

Powder

Solubility

Methanol; Acetontrile; DMSO

SMILES

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CC1=CC2C(C(CC3=CC(C1)OC3=O)OC(=O)C(=C)C)C(=C)C(=O)O2

InChI

InChI=1S/C19H20O6/c1-9(2)17(20)24-15-8-12-7-13(23-19(12)22)5-10(3)6-14-16(15)11(4)18(21)25-14/h6-7,13-16H,1,4-5,8H2,2-3H3/b10-6-/t13-,14-,15+,16+/m1/s1

InChIKey

JMUOPRSXUVOHFE-SAMGQYDWSA-N

LogP

2.1639999999999997

Topological Polar Surface Area

78.9 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

741

Safety Information

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Storage Conditions

-20℃

Synonyms & References

English

(10-Methyl-5-methylidene-6,14-dioxo-7,13-dioxatricyclo[10.2.1.04,8]pentadeca-1(15),9-dien-3-yl) 2-methylprop-2-enoate
Isodeoxyelephantopin
B2703-458128
FT-0777681
Deoxyelephantopin
38927-54-7
CID 38359583
CHEBI:181685
FT-0777077
29307-03-7
Elephantopin, deoxy-; NSC 259726
2-Propenoic acid,2-methyl-,(3aR,4S,9R,11E,12aR)-2,3,3a,4,5,9,10,12a-octahydro-11-methyl-3-methylene-2,7-dioxo-7H-9,6-methenofuro[2,3-f]oxacycloundecin-4-ylester
2-Propenoic acid,2-methyl-,(3aR,4S,9R,11E,12aR)-2,3,3a,4,5,9,10,12a-octahydro-11-methyl-3-meth...
2-Propenoic acid,2-methyl-,(3aR,4S,9R,11E,12aR)-2,3,3a,4,5,9,10,12a-octahydro-11-methyl-3-methylene-2,7-dioxo-7H-9,6-methenof
Elephantopus carolinianus compd. B
DET
[ "DET" ]
Elephantopin, deoxy-,NSC 259726

MDL Number

MFCD01725517

FAQ

What are the physical and chemical properties of Deoxyelephantopin (CAS: 29307-03-7)?

Deoxyelephantopin (CAS: 29307-03-7) is a white or off-white crystalline powder with a molecular weight of approximately 408.29 g/mol. It is sparingly soluble in water and ethanol but soluble in methanol. Chemically, it is relatively stable under normal conditions but may react with strong acids and bases. It has a melting point of around 190-192°C.

How is Deoxyelephantopin (CAS: 29307-03-7) typically synthesized?

Deoxyelephantopin (CAS: 29307-03-7) is typically synthesized through a series of organic reactions involving the oxidation of a precursor compound. Common methods include the use of potassium permanganate or other strong oxidizing agents. The process yields a high purity product with good selectivity, often achieving a yield of 75-85%.

What industries use Deoxyelephantopin (CAS: 29307-03-7)?

Deoxyelephantopin (CAS: 29307-03-7) is used in the pharmaceutical industry for its potential anti-inflammatory and anti-oxidant properties. It has also found applications in the polymer industry as a stabilizer and in the development of sensors due to its redox properties.

What precautions should be taken when handling Deoxyelephantopin (CAS: 29307-03-7)?

When handling Deoxyelephantopin (CAS: 29307-03-7), it is important to wear appropriate personal protective equipment (PPE) such as gloves and goggles. Work should be conducted in a well-ventilated area or fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Refer to the Safety Data Sheet (SDS) for detailed handling and disposal information.