[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride

C11H16ClN3O2

CAS23422-53-9
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
23422-53-9
EC Number
245-656-0
UN Number
2757
Index Number
006-052-00-0
PubChem CID
31899

Physical-chemical properties

Molecular Formula
C11H16ClN3O2
Molar Mass
257.72 g/mol
IUPAC Name
[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride

Chemical Identifiers

InChI
InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H
InChI Key
MYPKGPZHHQEODQ-UHFFFAOYSA-N

Overview

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate hydrochloride (CAS 23422-53-9) is a carbamate derivative compound with significant acute toxicity and environmental impact properties. This specialized chemical compound, with molecular formula C11H16ClN3O2 and molecular weight 257.72 g/mol, represents an important member of the carbamate family used in various industrial applications. The hydrochloride salt form enhances the compound's stability and solubility characteristics compared to its base form [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate, making it more suitable for specific technical applications. The compound exhibits distinctive structural features with its dimethylaminomethylideneamino group attached to a phenyl ring, combined with an N-methylcarbamate moiety. This unique molecular architecture contributes to its biological activity and chemical reactivity profile. Safety considerations are paramount when handling this material, as it carries multiple hazard classifications including Acute Toxicity Category 2, Skin Sensitization Category 1, and significant aquatic toxicity warnings. The presence of GHS06 and GHS09 pictograms indicates both acute toxicity and environmental hazards, requiring appropriate safety protocols during storage, handling, and transportation under ADR Class 6.1 regulations. Primary industrial applications include use as an intermediate in pharmaceutical synthesis, agricultural chemical manufacturing, and specialized research applications where controlled biological activity is required. The compound's carbamate functionality makes it particularly valuable in developing products with specific enzymatic inhibition properties, similar to other compounds in this chemical class such as N-methylaniline derivatives. OYSI maintains regular availability of this technical-grade compound for qualified industrial customers requiring reliable supply chains for their specialized chemical processes.

Safety & Classification

Danger
Classification:

Acute Tox. 2 *; Acute Tox. 2 *; Skin Sens. 1; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H330

Fatal if inhaled.

H300

Fatal if swallowed.

H317

May cause an allergic skin reaction.

H400

Very toxic to aquatic life.

H410

Very toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Inhalation

Fatal

Measures if vapours or dust are inhaled

First Aid Actions

  • +P304IF INHALED:
  • +P340Remove person to fresh air and keep comfortable for breathing.
  • +P311Call a POISON CENTER/doctor.

Related hazard statements:

Skin Contact

Irritant

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Fatal

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number2757
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping NameFormetanat-hydrochlorid
Marine PollutantNo

Frequently Asked Questions

What is [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride is a synthetic organic compound with the molecular formula C11H16ClN3O2 and CAS number 23422-53-9. This chemical belongs to the carbamate family and has a molecular weight of 257.72 g/mol. It is classified as a highly toxic substance with acute toxicity category 2 and poses significant environmental hazards to aquatic organisms. The compound requires careful handling due to its dangerous properties and potential health risks.

What are the physicochemical properties of [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride is a solid compound at room temperature with a molecular weight of 257.72 g/mol. The presence of the hydrochloride salt form typically enhances its water solubility compared to the free base. The compound contains multiple functional groups including carbamate, amine, and aromatic components, which influence its chemical reactivity and stability. Specific physical properties such as melting point, color, and exact solubility data should be confirmed through technical documentation.

What is [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride used for?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride is primarily used in specialized chemical applications and research. As a carbamate compound, it may serve as an intermediate in pharmaceutical synthesis or as a research chemical for biochemical studies. Its specific applications depend on its biological activity and chemical properties. Due to its high toxicity classification, its use is restricted to professional and industrial settings where appropriate safety measures can be implemented.

How to handle [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride safely?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride requires extreme caution during handling due to its Acute Tox. 2 classification. Essential personal protective equipment includes nitrile gloves, safety goggles, and respiratory protection in well-ventilated areas or fume hoods. Workers should wear protective clothing to prevent skin contact, as the compound is also a skin sensitizer. All handling should occur in controlled environments with emergency procedures readily available and trained personnel only.

How to store [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride correctly?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride must be stored in a cool, dry, well-ventilated area away from incompatible materials. Storage should be in original, tightly sealed containers with appropriate labeling including GHS06 and GHS09 pictograms. The storage area should be secured and accessible only to authorized personnel due to the substance's high toxicity. Temperature and humidity control may be necessary to maintain chemical stability and prevent degradation.

What to do in case of contact with [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride?

Immediate action is required for any contact with [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride due to its acute toxicity. For skin contact, remove contaminated clothing and rinse thoroughly with water for at least 15 minutes. If inhaled, move to fresh air immediately and seek medical attention. For eye contact, flush with clean water for 15 minutes and remove contact lenses if present. In all cases of exposure, seek immediate medical attention and provide the safety data sheet to medical personnel.

How to dispose of [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride properly?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride must be disposed of as hazardous waste according to local and EU regulations due to its toxicity and environmental hazard classification. Disposal should only be performed by licensed waste management companies specializing in toxic chemicals. The compound cannot be disposed of through normal waste streams or sewage systems due to its aquatic toxicity. Proper documentation and waste tracking are required throughout the disposal process.

How to transport [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride is classified as ADR Class 6.1 (toxic substances) Packing Group II for transport purposes. This classification requires specific packaging, labeling, and documentation according to ADR regulations for dangerous goods transport. Only certified carriers with appropriate permits can transport this material. Proper shipping documentation, emergency response information, and hazard labels must accompany all shipments to ensure safe transport and regulatory compliance.

Is [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride subject to specific regulations?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride is subject to REACH registration requirements and CLP classification regulations within the EU. While not currently listed as an SVHC substance, its Acute Tox. 2 classification imposes strict handling, labeling, and safety data sheet requirements. The compound may be subject to additional restrictions or authorization requirements depending on intended use. Companies must comply with occupational health regulations and potentially require special permits for handling such highly toxic substances.

Where to buy [3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride in Europe?

[3-(dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride is available through OYSI, a specialized European distributor of technical chemicals. As a highly regulated toxic substance, it is only sold to qualified industrial and research customers with appropriate handling capabilities and regulatory compliance. OYSI ensures proper documentation, safety data sheets, and regulatory compliance for all shipments. Customers must demonstrate legitimate use and adequate safety measures before purchase authorization due to the compound's hazardous classification.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.