5-Methyl-2-phenyl-2-hexenal

Basic Information

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CAS Number

21834-92-4

Molecular Formula

C13H16O

Molecular Weight

188.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

100°C/7mmHg

Flash Point

>110 ºC

Refractive Index

1.534

SMILES

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CC(C)CC=C(C=O)C1=CC=CC=C1

InChI

InChI=1S/C13H16O/c1-11(2)8-9-13(10-14)12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3/b13-9-

InChIKey

YURDCJXYOLERLO-LCYFTJDESA-N

LogP

3.315000000000002

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

197

Safety Information

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GHS Hazard Pictograms

H315

H319

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Sensitiveness

Air Sensitive

Synonyms & References

English

FEMA No. 3199
(E)-5-methyl-2-phenylhex-2-enal
EINECS 244-602-3
DS-11320
188829-73-4
(2E)-5-methyl-2-phenylhex-2-enal
W-107517
(2E)-5-methyl-2-phenyl-hex-2-enal
alpha-(3-Methylbutylidene)-Benzeneacetaldehyde
(2E)-5-Methyl-2-phenyl-2-hexenal
5-Methyl-2-phenylhex-2-enal
Benzeneacetaldehyde, alpha-(3-methylbutylidene)-, (alphaE)-
2-Hexenal, 5-methyl-2-phenyl-
WAA83492
Q27271558
AKOS024348946
Benzeneacetaldehyde, alpha-(3-methylbutylidene)-
5-Methyl-2-phenyl-hex-2-enal, (2E)-
MFCD00036615
5-Methyl-2-phenyl-2-hexenal, >=96%, FG
UNII-57UW55EC13
Cocal
Benzeneacetaldehyde, .alpha.-(3-methylbutylidene)-
FEMA 3199
alpha-(3-Methylbutylidene)benzeneacetaldehyde
5-Methyl-2-phenyl-2-hexenal
935DI670UJ
21834-92-4
(E)-5-Methyl-2-phenyl-hex-2-enal
BENZENEACETALDEHYDE, .ALPHA.-(3-METHYLBUTYLIDENE)-, (E)-
UNII-935DI670UJ

MDL Number

MFCD00036615

Customs Code

2912299000

FAQ

What regulatory guidelines apply to 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4)?

5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4) follows regulatory guidelines such as the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH (European Union Regulation on Registration, Evaluation, Authorization and Restriction of Chemicals), and FDA/EPA requirements. It is important to adhere to local and international safety standards for handling and storage to ensure compliance.

Are there alternatives to 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4) in synthesis?

In synthesis, various alternatives to 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4) can be used, such as 2-Phenyl-2-hexenal, or other hexenal derivatives. These alternatives can offer similar functional groups but with different substituents, providing flexibility in chemical synthesis processes.

What is the market or research trend for 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4)?

The market and research trend for 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4) is focused on its potential applications in flavors and fragrances, as well as in the development of new chemical reactions. Recent studies are exploring its use in bioactive compounds and as a precursor in organic synthesis.

How should waste containing 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4) be handled?

Waste containing 5-Methyl-2-phenyl-2-hexenal (CAS: 21834-92-4) should be collected in appropriate containers and disposed of according to local regulations. Safe incineration or professional waste disposal services are recommended. Environmental protection measures should be taken to prevent contamination of soil and water sources.