Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate

Basic Information

View in Editor

CAS Number

83055-99-6

Molecular Formula

C16H18N4O7S

Molecular Weight

410.41 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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

179-184 °C

Boiling Point

°Cat760mmHg

Density

1.438

Refractive Index

1.591

SMILES

View in Editor

COc1cc(nc(n1)NC(=O)NS(=O)(=O)Cc2ccccc2C(=O)OC)OC

InChI

InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)

InChIKey

XMQFTWRPUQYINF-UHFFFAOYSA-N

LogP

0.9318999999999997

Topological Polar Surface Area

145.80999999999997 Å²

Hydrogen Bond Donor/Acceptor

2 / 11

Complexity

627

Safety Information

View Safety Information

GHS Hazard Pictograms

H317

H411

Hazard Statement

H317 May cause an allergic skin reaction
Sensitization, Skin

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Sensitiveness

对光敏感

Synonyms & References

English

Bensulfuron-Methyl (Patented-No-Supply)
Bensulfuron methyl
methyl2-[[[[[(4,6-dimethoxypyrimidin-2-yl)-amino]carbonyl]amino]sulfonyl]methyl]benzoate
Bensulfuron-Methyl
Bensulfuron-methyl solution
Bensulfuron-methyl Reference Material
BenzhydrylaMine
methyl 2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoate
methyl 2-[[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]methyl]benzoate
methyl α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluate
HX-111
2-[[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]methyl]benzoic acid methyl ester
Bensulfuron Me
DPX-F5384
Londax
Methyl 2-((((((4,6-dimethoxy-2-pyrimidinyl)amino)carbonyl)amino)s
Methyl 2-((((((4,6-dimethoxy-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)methyl)benzoate

MDL Number

MFCD00128064

Customs Code

2935009013

FAQ

What is Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate (CAS: 83055-99-6)?

Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate is a chemical compound with the CAS number 83055-99-6. It is a derivative of benzoic acid, featuring a complex structure with a sulfamoyl group and a carbamoyl group attached to a pyrimidine ring. This compound is known for its potential applications in medicinal chemistry and is often used as an intermediate in the synthesis of pharmaceuticals.

What are the main uses of Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate (CAS: 83055-99-6)?

Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate is primarily used in pharmaceutical research as an intermediate in the development of drugs targeting various diseases. It may also find applications in chemical synthesis and industrial processes involving functionalized aromatic compounds.

Is Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate (CAS: 83055-99-6) safe?

The safety of Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate depends on its handling and application. As a chemical intermediate, it should be treated with care, using appropriate personal protective equipment. It is important to follow safety guidelines and regulatory standards to ensure safe use in laboratory and industrial settings.

How should Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate (CAS: 83055-99-6) be stored?

Methyl 2-({[(4,6-dimethoxy-2-pyrimidinyl)carbamoyl]sulfamoyl}methyl)benzoate should be stored in a cool, dry, and well-ventilated area away from direct light. It is recommended to keep it in a sealed container to prevent moisture exposure. Storage conditions should maintain a temperature below 25°C and humidity levels below 60% to ensure stability and prolong shelf life.