N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid

Basic Information

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CAS Number

330-54-1

Molecular Formula

C9H10Cl2N2O

Molecular Weight

233.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

157.0 to 160.0 deg-C

Boiling Point

180-190°C

Refractive Index

1.5500 (estimate)

SMILES

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CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1

InChI

InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)

InChIKey

XMTQQYYKAHVGBJ-UHFFFAOYSA-N

LogP

3.0869000000000018

Topological Polar Surface Area

32.34 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

211

Safety Information

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GHS Hazard Pictograms

H302

H351

H373

H410

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H351 Suspected of causing cancer
Carcinogenicity

H373 Causes damage to organs through prolonged or repeated exposure
Specific target organ toxicity, repeated exposure

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

Hazard Class

Class 9 Class 9

Stability

Stable. Incompatible with strong acids, strong bases, strong oxidizing agents.

Toxicity

LD50 orally in rats: 1690 mg/kg (Boyd, Krupa)

Synonyms & References

English

Diuron
DCMU
Dichlorfenidim
Karmex
3-(3,4-Dichlorophenyl)-1,1-dimethylurea
Diuron Solution
3-(3,4-DICHLORO-PHENYL)-1,1-DIMETHYL-UREA
N-(3,4-Dichlorophenyl)-N,N-Dimethylurea
N’-(3,4-dichlorophenyl)-N,N-dimethylurea
Fomesafen
1,1-Dimethyl-3-(3,4-Dichlorophenyl)urea
1-(3,4-Dichlorophenyl)-3,3-dimethylurea
N'-(3,4-Dichlorophenyl)-N,N-Dimethylurea
Aguron
Diater
Direx 4L
Antiseptic

MDL Number

MFCD00018136

Customs Code

2924299032

FAQ

What is N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1)?

N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1) is a chemical compound with the molecular formula C10H10Cl2N2O2. It is a white crystalline solid known for its stability and moderate solubility in polar solvents. This compound belongs to the class of carbamimidic acids and contains a 3,4-dichlorophenyl group attached to an N,N-dimethylurea moiety, making it a key intermediate in various chemical applications.

What are the main uses of N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1)?

N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1) is widely used in the pharmaceutical industry as an intermediate for drug development, particularly in pesticide and herbicide formulations. It also finds applications in agricultural chemicals and research settings for synthesizing other compounds. Its chemical structure makes it valuable for creating bioactive molecules with specific functional groups.

Is N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1) safe?

N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1) requires careful handling due to its potential toxicity. While it is not classified as highly hazardous, skin contact and inhalation may cause irritation. Safety standards emphasize the use of protective gear, such as gloves and safety goggles, and working in a well-ventilated area. Always follow OSHA guidelines for chemical exposure.

How should N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1) be stored?

N'-(3,4-Dichlorophenyl)-N,N-dimethylcarbamimidic acid (CAS: 330-54-1) should be stored in a cool, dry place, away from direct light and moisture. Keep it in a sealed, airtight container to maintain stability. Storage conditions should be controlled to prevent degradation, and it is recommended to store in a ventilated area to minimize exposure risks.