4-(4-Hydroxyphenyl)but-3-en-2-one

Basic Information

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CAS Number

3160-35-8

Molecular Formula

C10H10O2

Molecular Weight

162.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

104.0 to 109.0 deg-C

Boiling Point

318.1 °C at 760 mmHg

Density

1.138

Flash Point

134.8 °C

Solubility

Optimally soluble in aqueous solvents.

Refractive Index

1.599

SMILES

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CC(=O)C=CC1=CC=C(C=C1)O

InChI

InChI=1S/C10H10O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h2-7,12H,1H3/b3-2+

InChIKey

OCNIKEFATSKIBE-NSCUHMNNSA-N

LogP

1.9944000000000002

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

176

Synonyms & References

English

4-Hydroxybenzal acetone
CS-0356795
1-(4-Hydroxybenzylidene)acetone
4-Hydroxystyryl methyl ketone
J-018486
Methyl P-Hydroxycinnamyl Ketone
4-Hydroxybenzalacetone
(E)-4-(4-Hydroxyphenyl)-3-buten-2-one
22214-30-8
EN300-1858559
4-(p-Hydroxyphenyl)-3-buten-2-one
AKOS005207153
EINECS 221-607-9
CHEMBL9184
CHEBI:68636
DTXSID201287493
NSC 26516
MFCD00016490
3-Buten-2-one, 4-(4-hydroxyphenyl)-
CS-B1377
Q27137063
(3E)-4-(4-hydroxyphenyl)but-3-en-2-one
3-Buten-2-one, 4-(p-hydroxyphenyl)-
8MK
(E)-4-(4-hydroxyphenyl)but-3-en-2-one
p-Hydroxybenzalacetone
3160-35-8
p-Hydroxybenzylidene acetone
AS-61561
3-Buten-2-one,4-(4-hydroxyphenyl)-,(3E)-
4-hydroxybenzylideneacetone

MDL Number

MFCD00016490

FAQ

What regulatory guidelines apply to 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8)?

4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8) falls under the GHS classification as a chemical that may cause skin irritation and eye irritation. Under REACH regulations, it is classified as a substance of very high concern due to its carcinogenic potential. FDA and EPA require strict handling and storage conditions to prevent exposure. Companies must comply with these guidelines to ensure safety and regulatory compliance.

Are there alternatives to 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8) in synthesis?

Yes, several alternatives can be used in the synthesis of 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8). Common substitutes include 4-hydroxybenzaldehyde and 4-methyl-3-pentenoic acid. These alternatives offer similar functionality but may have different reactivity and synthesis conditions, making them viable options for researchers and manufacturers.

What is the market or research trend for 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8)?

The market for 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8) is growing due to its applications in pharmaceuticals and agrochemicals. Recent research trends focus on its potential as a precursor for the synthesis of various bioactive compounds. Price trends indicate a steady demand, with minor fluctuations tied to supply chain issues and raw material costs. Emerging research is exploring its use in natural product chemistry and as a possible antioxidant.

How should waste containing 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8) be handled?

Waste containing 4-(4-Hydroxyphenyl)but-3-en-2-one (CAS: 3160-35-8) should be collected in a sealed container and disposed of according to local hazardous waste regulations. Incineration is a common method for disposal, ensuring complete destruction of the compound. Alternatively, professional waste disposal services can handle the waste safely. Environmental protection measures include minimizing spillage and ensuring proper handling to prevent contamination of water and soil.