Ethyl 4-hydroxycyclohexanecarboxylate

Basic Information

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CAS Number

17159-80-7

Molecular Formula

C9H16O3

Molecular Weight

172.22 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 Physical Properties

Boiling Point

127-134 °C/0.1 mmHg

Water Solubility

Not miscible or difficult to mix in water.

Refractive Index

n20/D 1.466(lit.)

SMILES

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CCOC(=O)C1CCC(CC1)O

InChI

InChI=1S/C9H16O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h7-8,10H,2-6H2,1H3

InChIKey

BZKQJSLASWRDNE-UHFFFAOYSA-N

LogP

1.1006

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

148

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

4-Hydroxycyclohexanecarboxylic acid ethyl ester
4-hydroxy cyclo-hexane carboxylic acid ethyl ester
AI3-28355
AS-18158
Ethyl 4-Hydroxy Cyclo Hexane Carboxylate
H11890
AC-5139
4-ethoxycarbonylcyclohexanol
SY011568
CS-W008169
ethyl 4-hydroxycyclohexane-carboxylate
UNII-DYE45Z9SRP
BZKQJSLASWRDNE-OCAPTIKFSA-N
AKOS015855262
AM9678
SB38620
Cyclohexanecarboxylic acid, 4-hydroxy-, ethyl ester, cis-
Not available;trans-Ethyl 4-hydroxycyclohexanecarboxylate
trans ethyl 4-hydroxycyclohexanecarboxylate
Ethyl 4-hydroxycyclohexanecarboxylate pound>>Cyclohexanecarboxylicacid, 4-hydroxy-, ethyl ester
AKOS015903755
ethyl-4-hydroxy-cyclohexane carboxylate
BZKQJSLASWRDNE-ZKCHVHJHSA-N
MFCD23701492
FT-0699771
Ethyl 4-hydroxycyclohexanecaboxylate
R7LV2TYU78
AC-496
Ethyl 4-hydroxycyclohexanecarboxylate
A854626
DTXSID001189263

MDL Number

MFCD00192156

Customs Code

2918199090

FAQ

What regulatory guidelines apply to Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7)?

Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7) falls under the scope of GHS (Globally Harmonized System of Classification and Labelling of Chemicals) and is subject to REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) regulations in the European Union. In the USA, it is regulated by the FDA (Food and Drug Administration) for pharmaceutical and food additives, and by the EPA (Environmental Protection Agency) for environmental protection and waste management.

Are there alternatives to Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7) in synthesis?

Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7) can be synthesized using alternative reagents such as ethyl 4-chlorocyclohexanecarboxylate or ethyl 4-methoxycyclohexanecarboxylate. These alternatives offer similar functionalities and can be used in various chemical processes, providing flexibility in synthetic approaches.

What is the market or research trend for Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7)?

The market for Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7) is growing due to its applications in pharmaceuticals and fine chemicals. Research trends are focusing on its use in drug discovery and development, particularly in anti-inflammatory and anti-tumor agents. The demand is also influenced by its potential in polymer synthesis as a monomer.

How should waste containing Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7) be handled?

Waste containing Ethyl 4-hydroxycyclohexanecarboxylate (CAS: 17159-80-7) should be collected in appropriate containers and disposed of through professional waste disposal services that comply with environmental protection regulations. Incineration or other approved chemical waste disposal methods should be used, ensuring that all safety and environmental precautions are followed. Proper labeling and documentation of the waste should also be maintained.