2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol

Basic Information

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CAS Number

682-11-1

Molecular Formula

C9H18O3

Molecular Weight

174.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

-10℃

Boiling Point

160.5℃

Density

1.01 g/mL at 25 °C

Flash Point

>230 °F

Refractive Index

n20/D 1.467(lit.)

SMILES

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CCC(CO)(CO)COCC=C

InChI

InChI=1S/C9H18O3/c1-3-5-12-8-9(4-2,6-10)7-11/h3,10-11H,1,4-8H2,2H3

InChIKey

LZDXRPVSAKWYDH-UHFFFAOYSA-N

LogP

0.57

Topological Polar Surface Area

49.69 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

119

Synonyms & References

English

MFCD00046753
2-(allyloxymethyl)-2-ethylpropane-1,3-diol
112W61CL04
Trimethylolpropane monoallyl ether
682-11-1
1-Butanol, 2,2-(dihydroxymethyl)-, monoallyl ether
Q27251216
1,3-Propanediol, 2-ethyl-2-[(2-propenyloxy)methyl]-
2-Allyloxymethyl-2-ethylpropanediol
BRN 1854856
2-ethyl-2-(prop-2-enoxymethyl)propane-1,3-diol
AI3-26933
NS00006785
FT-0707696
Trimethylolpropane allyl ether
EINECS 211-662-7
1,3-Propanediol, 2-ethyl-2-((2-propen-1-yloxy)methyl)-
EC 211-662-7
UNII-112W61CL04
SCHEMBL111075
W-109592
1,1,1-Trimethylolpropane monoallyl ether
Trimethylolpropane allyl ether, 98%
1,3-Propanediol, 2-ethyl-2-((2-propenyloxy)methyl)-
1,1,1-(TRIHYDROXYMETHYL)PROPANE MONOALLYL ETHER
TRIMETHYLOLPROPANEMONOALLYLETHER
ETHER, ALLYL (2,2-BIS(HYDROXYMETHYL)BUTYL)
LZDXRPVSAKWYDH-UHFFFAOYSA-N
TRIMETHYLOL PROPANE MONOALLYL ETHER
DTXSID5052674
1,3-Propanediol,2-ethyl-2-[(2-propen-1-yloxy)methyl]-

MDL Number

MFCD00046753

Customs Code

2909499000

FAQ

What regulatory guidelines apply to 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1)?

2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1) is subject to various regulatory guidelines. Globally, it falls under the GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazard classification. In the European Union, it is regulated under REACH (Registration, Evaluation, Authorization and Restriction of Chemicals). For safety data sheets and handling, it's important to comply with FDA and EPA regulations. Ensure all storage and transport follow the relevant guidelines to prevent environmental contamination and ensure safe use.

Are there alternatives to 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1) in synthesis?

Several alternatives can be used as substitutes for 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1) in synthesis, depending on the specific reaction conditions. Isomers such as 2-[(Propenyloxy)methyl]-1,3-propanediol or other alcohols like 2-Ethyl-1,3-propanediol can serve as viable alternatives. Additionally, other reagents like glycols or diols with similar functionalities can be explored. Always assess the compatibility and efficiency of these alternatives in the specific synthesis context.

What is the market or research trend for 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1)?

The market for 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1) is steadily growing due to its applications in pharmaceuticals, cosmetics, and adhesives. Research trends focus on its use as a monomer in polymer synthesis and as a cosmetically active ingredient. Price trends show fluctuation based on demand and supply dynamics. Emerging research emphasizes the development of safer and more sustainable derivatives of this compound.

How should waste containing 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1) be handled?

Waste containing 2-[(Allyloxy)methyl]-2-ethyl-1,3-propanediol (CAS: 682-11-1) should be collected in appropriate containers and stored under controlled conditions to prevent environmental contamination. For disposal, incineration or professional waste disposal services are recommended. Ensure all handling and disposal activities comply with local regulations. Implement proper personal protective equipment and follow safety protocols to minimize health risks and environmental impact.