Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester

Basic Information

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CAS Number

30431-54-0

Molecular Formula

C26H24Cl6O8

Molecular Weight

677.2 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

81.0 to 84.0 deg-C

Solubility

Insuluble (4.5E-8 g/L) (25 ºC),

SMILES

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CCCCCOC(=O)C1=C(C(=CC(=C1Cl)Cl)Cl)OC(=O)C(=O)OC2=C(C(=C(C=C2Cl)Cl)Cl)C(=O)OCCCCC

InChI

InChI=1S/C26H24Cl6O8/c1-3-5-7-9-37-23(33)17-19(31)13(27)11-15(29)21(17)39-25(35)26(36)40-22-16(30)12-14(28)20(32)18(22)24(34)38-10-8-6-4-2/h11-12H,3-10H2,1-2H3

InChIKey

TZZLVFUOAYMTHA-UHFFFAOYSA-N

LogP

8.812

Topological Polar Surface Area

105.2 Å²

Hydrogen Bond Donor/Acceptor

0 / 8

Complexity

795

Safety Information

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Hazard Statement

Synonyms & References

English

Dipentyl O,O'-oxalyl-bis(3,5,6-trichlorosalicylate)
FT-0623115
Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester
D70542
EINECS 250-195-3
W-106942
O0236
Bis[2,4,5-trichloro-6-(pentyloxycarbonyl)phenyl] Oxalate
Ethanedioic acid, bis(3,4,6-trichloro-2-((pentyloxy)carbonyl)phenyl) ester
NS00004599
CPPO
pentyl 2,3,5-trichloro-6-[(2-oxo-2-{3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenoxy}acetyl)oxy]benzoate
SCHEMBL79416
MFCD00191674
30431-54-0
BIS(2,4,5-TRICHLORO-6-CARBOPENTYLOXYPHENYL)OXALATE
bis-(2,4,5-trichloro-6-(pentyloxycarbonyl)phenyl)oxalate
Bis[3 pound not4 pound not6-trichloro-2-(pentyloxycarbonyl)phenyl] Oxalate
AS-73536
Bis(2,4,5-trichloro-6-carbopentoxyphenyl) oxalate
UNII-44594F9XR2
bis(3,4,6-trichloro-2-(pentyloxycarbonyl)phenyl) oxalate
C26H24Cl6O8
Q15410297
Oxalic Acid Bis[2,4,5-trichloro-6-(pentyloxycarbonyl)phenyl] Ester
OXALIC ACID, DIESTER WITH PENTYL 3,5,6-TRICHLOROSALICYLATE
Bis(2-carbopentyloxy-3,4,6-trichlorophenyl) oxalate
44594F9XR2
Bis[3,4,6-trichloro-2-(pentyloxycarbonyl)phenyl] oxalate
BIS(3,4,6-TRICHLORO-2-(PENTYLOXYCARBONYL)PHENYL)OXALATE
CS-0152132

MDL Number

MFCD00191674

FAQ

What are the physical and chemical properties of Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester (CAS: 30431-54-0)?

Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester is a solid compound with a crystalline form and a molecular weight of approximately 729.14 g/mol. It has limited solubility in water and ethanol. This compound is reactive and can undergo hydrolysis and substitution reactions.

How is Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester (CAS: 30431-54-0) typically synthesized?

Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester is synthesized through esterification of ethanedioic acid with 3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenol. The reaction involves the use of a catalyst, typically an acid such as sulfuric acid, and is carried out under mild to moderate conditions to achieve a good yield.

What industries use Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester (CAS: 30431-54-0)?

Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester finds applications in the pharmaceutical and polymer industries. It can be used as an intermediate in the synthesis of more complex organic compounds and as a modifier in polymer formulations to enhance certain properties.

What precautions should be taken when handling Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester (CAS: 30431-54-0)?

When handling Ethanedioic acid, 1,2-bis[3,4,6-trichloro-2-[(pentyloxy)carbonyl]phenyl] ester, it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation. Spills should be handled carefully and cleaned up using appropriate chemicals and disposal methods. Refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.