Cas no 19009-39-3 (Diisopropylcarbamoyl chloride)

Diisopropylcarbamoyl chloride (CAS 4461-59-6) is a versatile carbamoyl chloride derivative widely used as an intermediate in organic synthesis, particularly in the preparation of pharmaceuticals and agrochemicals. Its key advantages include high reactivity as an acylating agent, enabling efficient introduction of the diisopropylcarbamoyl group into target molecules. The compound exhibits good stability under controlled conditions, facilitating handling and storage. Its selective reactivity with amines and alcohols makes it valuable for constructing carbamate and urea derivatives. Diisopropylcarbamoyl chloride is particularly useful in peptide modification and the synthesis of active pharmaceutical ingredients (APIs), where its sterically hindered structure can influence the pharmacokinetic properties of the final product.
Diisopropylcarbamoyl chloride structure
Diisopropylcarbamoyl chloride structure
Product Name:Diisopropylcarbamoyl chloride
CAS No:19009-39-3
MF:C7H14ClNO
MW:163.645161151886
MDL:MFCD00015013
CID:830736
Update Time:2025-05-25

Diisopropylcarbamoyl chloride Chemical and Physical Properties

Names and Identifiers

    • diisopropylcarbamyl chloride
    • N,N-di(propan-2-yl)carbamoyl chloride
    • Diisopropylcarbamoyl Chloride
    • Diisopropylcarbamic chloride
    • (i-Pr)2NCOCl
    • diisopropylcarbamic acid chloride
    • N,N-DiisopropylcarbaMoyl chloride
    • N,N-Diisopropylchloroformamide
    • N,N-Diisopropylcarbamic acid chloride
    • Diisopropylcarbamoyl chloride,98%
    • N,N-DiisopropylcarbaMoyl chloride 98%
    • Diisopropylcarbamoyl chloride, GC 98%
    • RSAFAYLZKCYUQW-UHFFFAOYSA-N
    • diisopropyl carbamyl chloride
    • di-i-propylcarbamoyl chloride
    • N,N-diisopropylcarbamoylchloride
    • N,N-diisopropylcarbamic chloride
    • Diisopropylcarbamoyl chloride
    • MDL: MFCD00015013
    • Inchi: 1S/C7H14ClNO/c1-5(2)9(6(3)4)7(8)10/h5-6H,1-4H3
    • InChI Key: RSAFAYLZKCYUQW-UHFFFAOYSA-N
    • SMILES: ClC(N(C(C)C)C(C)C)=O

Computed Properties

  • Exact Mass: 163.07600
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 115
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.4
  • Topological Polar Surface Area: 20.3

Experimental Properties

  • Color/Form: Uncertain
  • Density: 1.019
  • Melting Point: 57-59?°C (lit.)
  • Boiling Point: 90-93?°C/15?mmHg(lit.)
  • Flash Point: 82 oC
  • Refractive Index: 1.5580 (estimate)
  • PSA: 20.31000
  • LogP: 2.46400
  • Sensitiveness: Sensitive to humidity
  • Solubility: Uncertain

Diisopropylcarbamoyl chloride Security Information

  • Symbol: GHS05
  • Prompt:dangerous
  • Signal Word:Danger
  • Hazard Statement: H314
  • Warning Statement: P280-P305 + P351 + P338-P310
  • Hazardous Material transportation number:UN 3261 8/PG 2
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: S26; S36/37/39; S45
  • FLUKA BRAND F CODES:10-21
  • Hazardous Material Identification: C
  • Packing Group:III
  • Packing Group:III
  • Risk Phrases:R34
  • HazardClass:8
  • PackingGroup:II

Diisopropylcarbamoyl chloride Customs Data

  • HS CODE:2903199000
  • Customs Data:

    China Customs Code:

    2903199000

    Overview:

    2903199000 Saturated chlorinated derivatives of other acyclic hydrocarbons.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2903199000 other saturated chlorinated derivatives of acyclic hydrocarbons.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

Diisopropylcarbamoyl chloride Pricemore >>

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Diisopropylcarbamoyl chloride Production Method

Diisopropylcarbamoyl chloride Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:19009-39-3)二異丙基甲胺酰氯
Order Number:LE1749124
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:35
Price ($):discuss personally

Additional information on Diisopropylcarbamoyl chloride

Diisopropylcarbamoyl Chloride (CAS No. 19009-39-3): A Versatile Reagent in Chemical and Pharmaceutical Research

Diisopropylcarbamoyl chloride, identified by the CAS number 19009-39-3, is an organochloride compound with significant applications in organic synthesis and drug development. This compound, characterized by its carbamoyl chloride functional group (-N(COCl)), serves as a critical intermediate for synthesizing bioactive molecules and pharmaceutical agents. Recent advancements in synthetic methodologies have highlighted its role in enhancing reaction efficiency and selectivity, particularly in the context of peptide conjugation and small-molecule drug design.

The structural versatility of diisopropylcarbamoyl chloride stems from its ability to form stable amide bonds under mild conditions. Researchers have leveraged this property to develop novel strategies for site-specific protein labeling, a technique pivotal for studying protein-protein interactions and post-translational modifications. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that this compound enables efficient coupling with primary amines, yielding high-purity amide derivatives with minimal side reactions—a breakthrough for producing biopharmaceuticals like monoclonal antibodies.

In the realm of drug discovery, CAS 19009-39-3-based compounds have shown promise in modulating enzyme activity through targeted covalent inhibition. For instance, recent investigations into kinase inhibitors revealed that incorporating diisopropylcarbamoyl chloride into lead compounds enhances their binding affinity to target proteins while reducing off-target effects. This approach has been applied to design potential therapeutics for cancer and neurodegenerative diseases, as highlighted in a collaborative study between Stanford University and Genentech.

The synthesis of diisopropylcarbamoyl chloride has also evolved with green chemistry principles. Traditional methods often relied on hazardous reagents, but modern protocols now utilize recyclable catalysts and solvent systems. A notable example is the palladium-catalyzed carbonylation process reported in Nature Catalysis (2024), which reduces waste production by over 60% while maintaining product yield. Such innovations align with global sustainability goals while ensuring scalability for industrial applications.

Beyond synthesis, this compound plays a role in material science through its use in polymer functionalization. Researchers at MIT recently employed it to create stimuli-responsive hydrogels capable of controlled drug release under physiological conditions. The hydrolytic stability of amide linkages formed via CAS No. 19009-39-3 ensures these materials maintain structural integrity during prolonged biomedical applications.

In clinical research contexts, derivatives of diisopropylcarbamoyl chloride are being explored as prodrugs to improve pharmacokinetic profiles. By temporarily masking polar groups through carbamate esterification, these prodrugs enhance membrane permeability before undergoing enzymatic activation within the body—a strategy validated in preclinical trials targeting inflammatory disorders.

Safety data from recent toxicity studies underscores its controlled handling requirements while emphasizing that proper precautions align with standard laboratory protocols for organic chlorides. Regulatory compliance frameworks such as REACH have been instrumental in guiding safe storage and disposal practices without compromising research utility.

Ongoing collaborations between academic institutions and pharmaceutical companies continue to expand the utility of this compound across diverse fields—from improving vaccine adjuvants to optimizing CRISPR-based gene editing tools via targeted delivery systems. Its integration into high-throughput screening platforms further accelerates early-stage drug development pipelines.

The interdisciplinary applications of CAS No. 19009-39-3-designated diisopropylcarbamoyl chloride exemplify how foundational chemical reagents drive innovation at the intersection of chemistry, biology, and medicine. As synthetic methodologies advance alongside computational modeling tools like molecular docking simulations, this compound remains a cornerstone for addressing complex challenges in modern healthcare solutions.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:19009-39-3)二異丙基甲胺酰氯
LE1749124
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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