Ethyl 2-oxocycloheptanecarboxylate

Basic Information

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CAS Number

774-05-0

Molecular Formula

C10H16O3

Molecular Weight

184.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

126°C/11mmHg

Density

1.04 g/mL at 25 °C

Flash Point

>230℉

Refractive Index

n20/D 1.483(lit.)

SMILES

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CCOC(=O)C1CCCCCC1=O

InChI

InChI=1S/C10H16O3/c1-2-13-10(12)8-6-4-3-5-7-9(8)11/h8H,2-7H2,1H3

InChIKey

MKRBAWHVHOVBOQ-UHFFFAOYSA-N

LogP

1.6989

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

198

Synonyms & References

English

DTXSID20299499
FT-0688737
2-oxo-cycloheptane-1-carboxylic acid ethyl ester
2-carboethoxy-cycloheptanone
MFCD00604086
MKRBAWHVHOVBOQ-UHFFFAOYSA-N
AS-49319
ETHYL 2-OXO-1-CYCLOOCTANECARBOXYLATE 9&
ethyl 2-oxocycloheptane-1-carboxylate
SCHEMBL3656801
2-carbethoxycycloheptanone
2-carboethoxycycloheptanone
774-05-0
Ethyl2-Oxocycloheptanecarboxylate
2-carbethoxy-cycloheptanone
NSC-131082
SY017443
A847750
AKOS016842450
EN300-42080
E1056
Ethyl 2-oxo-cycloheptanecarboxylate
NSC131082
FD9024
Cycloheptanecarboxylic acid, 2-oxo-, ethyl ester
AKOS003671428
Q-103575
2-carbetoxycycloheptanone
CS-0099478
Z425453600
ethyl 2-oxocycloheptanecarboxylate

MDL Number

MFCD00604086

Customs Code

2918300090

FAQ

What regulatory guidelines apply to Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0)?

Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0) must comply with various regulatory guidelines including the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations, and FDA/EPA requirements for chemical substances. It is classified as a chemical substance that may require registration under REACH and may have specific handling and labeling requirements under GHS.

Are there alternatives to Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0) in synthesis?

There are alternative reagents to Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0) in synthesis such as other carboxylic acid derivatives. For example, using Ethyl 2-oxocyclohexanecarboxylate or Ethyl 2-oxocyclopentanecarboxylate could be viable alternatives depending on the specific application and reaction conditions.

What is the market or research trend for Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0)?

The market for Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0) is driven by its use in pharmaceutical and polymer synthesis research. Recent trends show an increasing interest in exploring its potential as a precursor in organic synthesis. Emerging research focuses on its application in biodegradable polymers and drug delivery systems.

How should waste containing Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0) be handled?

Waste containing Ethyl 2-oxocycloheptanecarboxylate (CAS: 774-05-0) should be collected in appropriate sealed containers and disposed of through professional waste disposal services. Incineration is a common method, and environmental protection precautions must be taken to ensure the waste is handled safely and in compliance with local regulations.