Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate

Basic Information

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CAS Number

90982-32-4

Molecular Formula

C15H15ClN4O6S

Molecular Weight

414.83 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 Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

180-182 ºC

Boiling Point

°Cat760mmHg

Density

1.4727 (rough estimate)

Solubility

Freely soluble in aqueous solution

Refractive Index

1.6100 (estimate)

SMILES

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O=C(OCC)C1=CC=CC=C1S(=O)(NC(NC2=NC(OC)=CC(Cl)=N2)=O)=O

InChI

InChI=1S/C15H15ClN4O6S/c1-3-26-13(21)9-6-4-5-7-10(9)27(23,24)20-15(22)19-14-17-11(16)8-12(18-14)25-2/h4-8H,3H2,1-2H3,(H2,17,18,19,20,22)

InChIKey

NSWAMPCUPHPTTC-UHFFFAOYSA-N

LogP

1.8256999999999999

Topological Polar Surface Area

136.58 Å²

Hydrogen Bond Donor/Acceptor

2 / 10

Complexity

628

Safety Information

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GHS Hazard Pictograms

H332

Hazard Statement

H332 Harmful if inhaled
Acute toxicity, inhalation

Toxicity

LD50 in male, female rats (mg/kg): 4102, 4236 orally (Claus)

Synonyms & References

English

Ethyl 2-(N-((4-chloro-6-methoxypyrimidin-2-yl)carbamoyl)sulfamoyl)benzoate
Chlorimuron Et
CHLORIMURON-ETHYL
chlorimuron ethyl ester
CLASSIC
CLASSIC 25 DF WEED KILLER(R)
classic 75df
DARBAN
DPX-F6025
ETHYL-2-[[[[(4-CHLORO-6-METHOXY-2-PYRIMIDINYL)AMINO]CARBONYL]AMINO]-SULFONYL] BENZOATE
2-(((((4-chloro-6-methoxy-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)benzoica
ethyl2-(((((4-chloro-6-methoxpyrimidin-2-yl)aminol)carbonyl)amino)sulfonyl)benzoate
ethyl2-(((((4-chloro-6-methoxypyrimidin-2-yl)-amino)carbonyl)amino)sulfonyl)b
Ethyl2-(((((4-chloro-6-methoxypyrimidin-2-yl)amino)carbonyl)amino)sulfonyl)benzoate
CHLORIMURON ETHYL, 100MG, NEAT
Classic[R]
Benzoic acid, 2-(4-chloro-6-methoxy-2-pyrimidinyl)aminocarbonylaminosulfonyl-, ethyl ester
Chlorsulfuron-ethyl
Chlorimuron W.P.
Chlorimuron ethyl
Chlorimuron-ethyl PESTANAL
ethyl 2-(4-chloro-6-methoxypyrimidin-2-ylcarbamoylsulfamoyl)benzoate
ethyl 2-[[[[(4-chloro-6-methoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]benzoate
ethyl 2-{[(4-chloro-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}benzoate
2-[[[[(4-Chloro-6-methoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]benzoic acid ethyl ester
Chlorimuron ethyl ester
Classic 75DF
Chlorimuron-ethyl
Classic
Classic 25DF
DPX-F 6025

MDL Number

MFCD00128063

Customs Code

2935009012

FAQ

What is Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4)?

Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate is a synthetic organic compound with the CAS number 90982-32-4. It contains a benzoate group linked to a sulfamoyl and carbamoyl structure, with substituents including a 4-chloro-6-methoxy-2-pyrimidinyl moiety. This compound is known for its pharmaceutical relevance and is often used as an intermediate in drug synthesis.

What are the main uses of Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4)?

Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4) is primarily used in pharmaceutical research as an intermediate for developing drugs. It may also find applications in organic synthesis and chemical manufacturing due to its functional groups and reactivity. Its specific utility is often tied to its role in creating compounds with bioactive properties.

Is Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4) safe?

Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4) is generally considered safe when handled properly. However, as a chemical compound, it should be treated with caution, and appropriate safety measures such as wearing gloves, goggles, and a lab coat are recommended. It is important to follow safety standards for handling and disposal to minimize risks.

How should Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4) be stored?

Ethyl 2-{[(4-chloro-6-methoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}benzoate (CAS: 90982-32-4) should be stored in a cool, dry, and well-ventilated place, away from direct light. It is best kept in a sealed container to prevent moisture exposure and maintain stability. Proper storage conditions help ensure its chemical integrity and safety during handling.