Cinosulfuron | CAS No. 94593-91-6

Cinosulfuron

Basic Information

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CAS Number

94593-91-6

Molecular Formula

C15H19N5O7S

Molecular Weight

413.41 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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

140-145 °C

Boiling Point

224°C (rough estimate)

Density

1.4192 (rough estimate)

Refractive Index

1.6460 (estimate)

SMILES

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COCCOC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OC)OC

InChI

InChI=1S/C15H19N5O7S/c1-24-8-9-27-10-6-4-5-7-11(10)28(22,23)20-13(21)16-12-17-14(25-2)19-15(18-12)26-3/h4-7H,8-9H2,1-3H3,(H2,16,17,18,19,20,21)

InChIKey

WMLPCIHUFDKWJU-UHFFFAOYSA-N

LogP

0.42440000000000017

Topological Polar Surface Area

150.86 Å²

Hydrogen Bond Donor/Acceptor

2 / 12

Complexity

576

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Cinosulfuron
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[2-(2-methoxyethoxy)phenyl]sulfonylurea
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[2-(2-methoxyethoxy)phenylsulfonyl]urea
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoyl]-2-(2-methoxyethoxy)benzene-1-sulfonamide
N-[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]carbonyl]-2-(2-methoxyethoxy)benzenesulfonamide
N-[2-(2-methoxyethoxy)-phenylsulfonyl]-N'-(4,6-bis-methoxy-1,3,5-triazin-2-yl)-urea
N-[2-(2-methoxyethoxy)-phenylsulphonyl]-N'-(4,6-dimethoxy-1,3,5-triazin-2-yl)-urea
3-(4-6-Dimethoxy-1,3,5-triazin-2-yl)-1-[2-(2-methoxyethoxy)-phenylsulfonyl]-urea
N-[[(4,6-Dimethoxy-1,3,5-triazin-2-yl)amino]carbonyl]-2-(2-methoxyethoxy)benzenesulfonamide (ACI)
CGA 142464
Dimetrasulfuron
Set-off
Q2972826
N-(((4,6-DIMETHOXY-1,3,5-TRIAZIN-2-YL)AMINO)CARBONYL)-2-(2-METHOXYETHOXY)BENZENESULFONAMIDE
53HYL452SB
DTXCID4031988
(N-(((4,6-dimethoxy-1,3,5-trizin-2-yl)amino)carbonyl)-2-(2-methoxyethoxy)benzenesulfonamide)
N-(4,6-dimethoxy-1,3,5-triazin-2-ylcarbamoyl)-2-(2-methoxyethoxy)benzenesulfonamide
N-[[(4,6-Dimethoxy-1,3,5-triazin-2-yl)amino]carbonyl]-2-(2-methoxyethoxy)benzenesulfonamide; CGA 142464; Dimetrasulfuron; Set-off;
1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-3-(2-(2-methoxyethoxy)phenylsulfonyl)urea (IUPAC)
CGA-142464
Benzenesulfonamide, N-[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]carbonyl]-2-(2-methoxyethoxy)-
DTXSID5058220
3-(4-6-dimethoxy-1,3,5-triazin-2-yl)-1-(2-(2-methoxyethoxy)phenylsulfonyl)urea
DB-057511
94593-91-6
C18818
WMLPCIHUFDKWJU-UHFFFAOYSA-N
Cinosulfuron [ISO]
SCHEMBL54807
UNII-53HYL452SB

MDL Number

MFCD01311813

FAQ

What are the physical and chemical properties of Cinosulfuron (CAS: 94593-91-6)?

Cinosulfuron is a crystalline compound with a molecular weight of approximately 337.33 g/mol. It is moderately soluble in water and organic solvents. Chemically, it is reactive towards acidic and basic conditions. It has good stability under normal storage conditions but is sensitive to high temperatures and strong oxidizing agents.

How is Cinosulfuron (CAS: 94593-91-6) typically synthesized?

Cinosulfuron is synthesized through a multi-step process involving the coupling of a sulfonyl chloride with a substituted phenol. This reaction is catalyzed by a phase transfer catalyst, and the product is isolated with high selectivity and yield. The process involves careful control of reaction conditions to achieve optimal results.

What industries use Cinosulfuron (CAS: 94593-91-6)?

Cinosulfuron is primarily used in the agricultural industry as a herbicide. It is also of interest in the pharmaceutical industry due to its potential as a herbicidal agent with selective weed control properties. Additionally, it shows promise in environmental science for soil remediation.

What precautions should be taken when handling Cinosulfuron (CAS: 94593-91-6)?

When handling Cinosulfuron, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. In case of a spill, use appropriate absorbent materials, and clean up under proper safety protocols. Always refer to the Safety Data Sheet (SDS) for detailed handling and safety information.