Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate

C14H18N4O3

methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate

CAS17804-35-2
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
17804-35-2
UN Number
3077
Index Number
613-049-00-3
PubChem CID
28780

Physical-chemical properties

Molecular Formula
C14H18N4O3
Molar Mass
290.32 g/mol
IUPAC Name
methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate

Chemical Identifiers

InChI
InChI=1S/C14H18N4O3/c1-3-4-9-15-13(19)18-11-8-6-5-7-10(11)16-12(18)17-14(20)21-2/h5-8H,3-4,9H2,1-2H3,(H,15,19)(H,16,17,20)
InChI Key
RIOXQFHNBCKOKP-UHFFFAOYSA-N

Overview

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate (CAS 17804-35-2) is a benzimidazole-derived carbamate compound with significant biological activity and pronounced safety considerations. This complex organic compound, with the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol, belongs to the benzimidazole carbamate family of chemicals. The substance exhibits a sophisticated molecular structure featuring both benzimidazole and carbamate functional groups, which contribute to its distinctive chemical and biological properties. The compound is classified under multiple serious hazard categories, including mutagenicity (Muta. 1B), reproductive toxicity (Repr. 1B), and specific target organ toxicity (STOT SE 3), requiring careful handling protocols and comprehensive safety measures. The substance presents significant safety challenges due to its hazard profile, which includes skin irritation and sensitization properties alongside its more severe systemic effects. It also demonstrates high aquatic toxicity, being classified as both Aquatic Acute 1 and Aquatic Chronic 1, indicating substantial environmental concerns. The compound falls under ADR Class 9 for transportation purposes, reflecting its miscellaneous dangerous goods classification. In industrial applications, methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate finds use in specialized chemical synthesis processes and as an intermediate in pharmaceutical research. Its benzimidazole structure makes it relevant in contexts where compounds like 4-[(4-amino-3-chlorophenyl)methyl]-2-chloroaniline are also utilized, particularly in advanced organic synthesis applications. The compound serves important functions in research and development activities within the agrochemical and pharmaceutical sectors. OYSI maintains availability of this specialized benzimidazole carbamate for qualified industrial customers requiring high-purity chemical intermediates for their technical applications.

Safety & Classification

Danger
Classification:

Muta. 1B; Repr. 1B; STOT SE 3; Skin Irrit. 2; Skin Sens. 1; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H340

May cause genetic defects.

H335

May cause respiratory irritation.

H315

Causes skin irritation.

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

Irritant

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:

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 Number3077
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping NameBenomyl (ISO)
Marine PollutantNo

Frequently Asked Questions

What is methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate is a benzimidazole carbamate compound with CAS number 17804-35-2. This organic chemical has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. It belongs to the carbamate family and features a complex structure combining benzimidazole and carbamate functional groups, making it useful in various industrial applications.

What are the physicochemical properties of methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate is an organic compound with molecular formula C14H18N4O3 and molecular weight 290.32 g/mol. The specific physical properties such as appearance, odor, and solubility depend on the exact formulation and purity grade. As a benzimidazole carbamate derivative, it typically exists as a solid under standard conditions and exhibits properties characteristic of carbamate compounds.

What is methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate used for?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate is primarily used in industrial applications where benzimidazole carbamate chemistry is required. Its specific applications depend on its biological activity and chemical properties. The compound may be utilized in pharmaceutical intermediates, agricultural formulations, or as a specialty chemical in research and development. Professional users should consult technical documentation for specific application guidelines and recommended use conditions.

How to handle methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate safely?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate requires careful handling due to its hazard classification including mutagenicity, reproductive toxicity, and skin sensitization. Essential protective equipment includes chemical-resistant gloves, safety goggles, and appropriate respiratory protection. Work in well-ventilated areas or under fume extraction. Avoid skin contact and inhalation. The substance carries the danger signal word and requires strict adherence to safety protocols during handling and processing.

How to store methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate correctly?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate must be stored in a cool, dry, well-ventilated area away from incompatible materials. Keep containers tightly closed and protect from moisture and direct sunlight. Due to its hazardous properties including mutagenicity and reproductive toxicity, storage areas should be restricted to authorized personnel only. Ensure proper labeling with GHS pictograms GHS08, GHS07, and GHS09, and maintain appropriate spill containment measures.

What to do in case of contact with methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate?

Immediate action is required upon contact with methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate due to its skin irritation and sensitization properties. For skin contact, remove contaminated clothing and wash thoroughly with soap and water for at least 15 minutes. In case of eye contact, rinse immediately with plenty of water. If inhaled, move to fresh air. Seek immediate medical attention, especially considering the substance's mutagenic and reproductive toxic properties. Inform medical personnel of the specific chemical involved.

How to dispose of methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate appropriately?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate disposal must comply with local, national, and EU waste regulations due to its hazardous classification. The substance requires specialized hazardous waste treatment and cannot be disposed of through normal waste streams. Contact licensed hazardous waste disposal companies for proper collection and treatment. Consider the aquatic toxicity (Aquatic Acute 1, Aquatic Chronic 1) when planning disposal methods. Maintain waste tracking documentation as required by applicable regulations.

How to transport methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate is classified as ADR Class 9 (Miscellaneous dangerous goods), Packing Group III for transport purposes. This classification requires appropriate packaging, labeling, and documentation according to dangerous goods regulations. Packages must bear proper shipping names, UN numbers, and hazard labels. Transport vehicles need appropriate placarding and drivers require ADR certification. Ensure compliance with international transport regulations for dangerous goods across European borders.

Is methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate subject to specific regulations?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate is subject to comprehensive EU chemical regulations including REACH registration requirements and CLP classification obligations. While not currently listed as an SVHC, its hazard profile requires strict compliance with worker protection, environmental protection, and chemical safety regulations. Users must implement appropriate risk management measures and maintain safety data sheets. The substance's mutagenic and reproductive toxic properties may trigger additional regulatory requirements in specific applications.

Where to buy methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate in Europe?

Methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides professional-grade chemical products with proper documentation, safety data sheets, and regulatory compliance support. As a hazardous substance requiring specialized handling and regulatory compliance, purchase should only be made through qualified chemical suppliers who can ensure proper packaging, transport, and documentation according to European chemical regulations.

Data Sources

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