N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide

Basic Information

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CAS Number

104040-78-0

Molecular Formula

C13H12F3N5O5S

Molecular Weight

407.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

164-166°

Boiling Point

°Cat760mmHg

Refractive Index

1.549

SMILES

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COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=N2)C(F)(F)F)OC

InChI

InChI=1S/C13H12F3N5O5S/c1-25-8-6-9(26-2)19-11(18-8)20-12(22)21-27(23,24)10-7(13(14,15)16)4-3-5-17-10/h3-6H,1-2H3,(H2,18,19,20,21,22)

InChIKey

HWATZEJQIXKWQS-UHFFFAOYSA-N

LogP

1.418

pKa

pKa (24°): 4.6

Topological Polar Surface Area

132.39999999999998 Å²

Hydrogen Bond Donor/Acceptor

2 / 10

Complexity

602

Safety Information

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GHS Hazard Pictograms

H410

Hazard Statement

H410 Very toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Toxicity

LD50 mice, rats (mg/kg): >5000, >5000 orally; in rats (mg/kg): >2000 dermally (Hashizume).

Synonyms & References

English

SL-160
Shibagen
DTXSID3034610
N-(((4,6-Dimethoxy-2-pyrimidinyl)amino)carbonyl)-3-(trifluoromethyl)-2-pyridinesulfonamide
Shibagen [Japanese]
HSDB 7957
NS00000142
Flazasulfuron [ISO]
N-(4,6-dimethoxypyrimidin-2-ylcarbamoyl)-3-(trifluoromethyl)pyridine-2-sulfonamide
1-(4,6-dimethoxy-2-pyrimidinyl)-3-[[3-(trifluoromethyl)-2-pyridinyl]sulfonyl]urea
FT-0642552
N-(4,6-Dimethoxy-2-pyrimidinylaminocarbonyl)-3-(trifluoromethyl)-2-pyridinesulfonamide
104040-78-0
SCHEMBL54678
J-001097
Q3073504
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(3-trifluoromethyl-2-pyridylsulfonyl)urea
CHEBI:81749
1-(4,6-dimethoxypyrimidin-2-yl)-3-[3-(trifluoromethyl)pyridin-2-yl]sulfonylurea
KATANA
F21476
UNII-3SB13WWV30
CHEMBL1878071
N-((4,6-dimethoxypyrimidin-2-yl)carbamoyl)-3-(trifluoromethyl)pyridine-2-sulfonamide
Flazasulfuron, PESTANAL(R), analytical standard
HWATZEJQIXKWQS-UHFFFAOYSA-N
AKOS015900343
A800883
FLAZASULFURON [MI]
CS-0440149
Flazasulfuron

MDL Number

MFCD00274594

FAQ

What regulatory guidelines apply to N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0)?

N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0) is subject to regulatory guidelines including GHS classification, REACH regulations, and FDA/EPA requirements. It is important to ensure compliance with local and international regulations regarding safety data sheets, labeling, and transportation.

Are there alternatives to N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide in synthesis?

While N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0) is a specific compound, there are alternative reagents such as other pyridine derivatives, sulfonamides, or pyrimidines that can be used in synthesis. These alternatives may offer similar functionalities but with different starting materials or synthetic routes.

What is the market or research trend for N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0)?

The market for N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0) is driven by its potential applications in pharmaceuticals and materials science. Research trends are focusing on its use as an intermediate in drug development and as a functional material. Market trends indicate increasing demand due to its unique chemical properties.

How should waste containing N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0) be handled?

Waste containing N-[(4,6-Dimethoxy-2-pyrimidinyl)carbamoyl]-3-(trifluoromethyl)-2-pyridinesulfonamide (CAS: 104040-78-0) should be collected and disposed of in accordance with local and international environmental regulations. Proper waste management includes incineration, professional waste disposal, and environmental protection measures to ensure safety and compliance. Always consult with local authorities for specific guidance.