(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one

Basic Information

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CAS Number

19902-91-1

Molecular Formula

C15H16O5

Molecular Weight

276.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Cryst.

Melting Point

118℃

Boiling Point

476.1 °C at 760 mmHg

Density

1.28

Flash Point

476.1 °C at 760 mmHg

Solubility

N/A

Refractive Index

1.575

Vapor Pressure

0.0±1.2 mmHg at 25°C

SMILES

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COC1=CC(=O)OC(C1)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H16O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h3,5-6,8,11H,2,4,7,9H2,1H3/t11-/m0/s1

InChIKey

RSIWXFIBHXYNFM-NSHDSACASA-N

LogP

2.1936999999999998

Topological Polar Surface Area

53.99000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

392

Safety Information

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Storage Conditions

-20℃

Synonyms & References

English

(+)-Dihydromethysticin
Pseudomethysticin
CHEMBL576066
MEGxp0_001718
C09926
(6S)-6-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dihydro-4-methoxy-2H-pyran-2-one
BRD-K87171303-001-01-2
Methysticin, 7,8-dihydro-
7,8-Dihydromethysticin
CHEBI:4573
HY-N0921
(S)-6-(2-(benzo[d][1,3]dioxol-5-yl)ethyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one
MFCD00221731
SCHEMBL14524443
SR-05000002272-2
AS-79324
SR-05000002272
J-018462
FZ66MQ73GS
ACon1_001371
2H-Pyran-2-one,3-benzodioxol-5-yl)ethyl]-5,6-dihydro-4-methoxy-, (S)-
FT-0700034
(+)-Dihydromethysticin(+)-Dihydromethysticin
ACon0_000957
Q-100244
DTXSID601314143
Q5276438
NSC 112159
Dihydromethysticin
19902-91-1

MDL Number

MFCD00221731

FAQ

What is (6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one (CAS: 19902-91-1)?

(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one is a colorless to white solid with a molecular formula of C15H16O4. It is characterized by its dihydro pyran ring and 1,3-benzodioxole group, making it useful in pharmaceutical and chemical synthesis applications.

What are the main uses of (6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one (CAS: 19902-91-1)?

(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one is primarily used in the synthesis of pharmaceuticals and as an intermediate in the chemical industry. It is also utilized in research for its unique structural features.

Is (6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one (CAS: 19902-91-1) safe?

(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one is generally considered safe when handled with appropriate precautions. Use gloves and protective eyewear to avoid skin and eye contact. Ensure proper ventilation during use and disposal. Follow standard laboratory safety guidelines.

How should (6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one (CAS: 19902-91-1) be stored?

(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one should be stored in a cool, dry place away from direct sunlight. Maintain a temperature of 15-25°C and a relative humidity below 60%. Store in a tightly sealed container to prevent moisture and light exposure. Keep out of reach of children and pets.