1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene

Basic Information

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CAS Number

4180-23-8

Molecular Formula

C10H12O

Molecular Weight

148.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

20-21 °C

Boiling Point

234-237 °C

Solubility

Soluble in benzene, ethyl acetate, acetone, carbon disulfide.

Refractive Index

n20/D 1.561(lit.)

Vapor Pressure

0.07 mmHg

Odor

ANISE OIL ODOR

SMILES

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COc1ccc(/C=C/C)cc1

InChI

InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+

InChIKey

RUVINXPYWBROJD-ONEGZZNKSA-N

LogP

2.728300000000001

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

121

Safety Information

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GHS Hazard Pictograms

H317

Hazard Statement

H317 May cause an allergic skin reaction
Sensitization, Skin

Storage Conditions

-20℃

Sensitiveness

Light Sensitive

Synonyms & References

English

Anethole, trans-
Anethol Natural
Anethole
trans-Anethole
(E)-1-Methoxy-4(1-propenyl)benzene
(E)-Anethol
(E)-Anethole
(E)-Anetole
Anethole (AS)
Anethole (E)
E-trans-Anethole
trans-Anethol
trans-p-Methoxypropenylbenzene
trans-p-Propenylanisole
p-Propenylanisole
1-Methoxy-4-propenylbenzene
1-Methoxy-4-((E)-propenyl)-benzene
4-Propenylanisole
(E)-1-Methoxy-4-(prop-1-en-1-yl)benzene
Anise camphor
cis-Anethol
Isoestragole
Anethol
p-Anethole
Oil of aniseed
Aniskampfer
Monasirup
(E)-p-Propenylanisole
p-1-Propenylanisole
(E)-1-(4-Methoxyphenyl)propene
Nauli gum

MDL Number

MFCD00009284

Customs Code

29093090

FAQ

What is 1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8)?

1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8) is an aromatic organic compound with the molecular formula C10H14O. It features a benzene ring substituted with a methoxy group at position 1 and an (E)-allyl group at position 4, making it a versatile intermediate in chemical synthesis. The compound is typically a liquid with low polarity and is used in various industrial and research applications due to its functional group reactivity.

What are the main uses of 1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8)?

1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8) is primarily used in pharmaceuticals as a building block for drug development, in industrial chemical synthesis for creating derivatives, and in research for studying organic reactions. It also finds applications in fragrance formulations and as a solvent in specific chemical processes, leveraging its aromatic and functional group properties.

Is 1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8) safe?

1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8) is generally considered safe when handled properly, but it may cause mild skin or eye irritation. Safety data sheets (SDS) recommend using appropriate protective equipment, such as gloves and goggles, and ensuring proper ventilation. It is a flammable liquid, so adherence to chemical safety standards and fire precautions is essential during storage and use.

How should 1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8) be stored?

1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene (CAS: 4180-23-8) should be stored in a cool, dry place away from direct light and heat sources. It requires airtight, sealed containers made of materials compatible with its chemical nature, such as glass or high-density polyethylene. Maintain stable conditions to prevent degradation, and ensure proper labeling to comply with chemical storage guidelines and safety regulations.