Cas no 698-90-8 (Cyclohexylurea)

Cyclohexylurea is a cyclic urea derivative characterized by its cyclohexyl substituent, which imparts unique steric and electronic properties. This compound is primarily utilized as an intermediate in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. Its rigid cyclohexyl ring enhances stability and influences reactivity, making it valuable for constructing complex molecular frameworks. Cyclohexylurea is also employed in research as a hydrogen-bonding scaffold due to its urea moiety. The compound exhibits moderate solubility in polar organic solvents, facilitating its use in various reaction conditions. Its well-defined structure and synthetic versatility make it a practical choice for specialized chemical applications.
Cyclohexylurea structure
Cyclohexylurea structure
Product Name:Cyclohexylurea
CAS No:698-90-8
MF:C7H14N2O
MW:142.198861598969
MDL:MFCD00014286
CID:39614
PubChem ID:69684
Update Time:2025-05-19

Cyclohexylurea Chemical and Physical Properties

Names and Identifiers

    • 1-CYCLOHEXYLUREA
    • CYCLOHEXYLUREA
    • N-CYCLOHEXLUREA
    • N-CYCLOHEXYLUREA
    • cyclohexyl-ure
    • Cyclohexylcarbamide
    • EINECS 211-822-6
    • monocyclohexylurea
    • Urea,cyclohexyl
    • Urea, cyclohexyl-
    • CYCLOHEXYL UREA
    • EYE4CFF4RV
    • WUESWDIHTKHGQA-UHFFFAOYSA-N
    • amino-N-cyclohexylamide
    • cyclohexyl-urea
    • n'-cyclohexylurea
    • N'-cyclohexyl-urea
    • N'-cyclohexyl urea
    • Urea, N-cyclohexyl-
    • HMS1609O11
    • MFCD00014286
    • BS-3808
    • NSC-27454
    • NSC27454
    • Z56896929
    • AKOS000120696
    • A836685
    • NSC-23790
    • C-9230
    • F1967-0964
    • AC-15251
    • SY049431
    • EC 211-822-6
    • AMY202100117
    • NSC23790
    • C2034
    • cyclohexylurea;1-Phenylurea
    • SCHEMBL78650
    • AC9450
    • UNII-EYE4CFF4RV
    • 698-90-8
    • MONOCYCLOHEXYL UREA
    • NSC 27454
    • FT-0607680
    • 4-12-00-00052 (Beilstein Handbook Reference)
    • NSC 23790
    • EN300-17167
    • NS00007982
    • DTXSID20220102
    • BRN 0636914
    • A834639
    • DTXCID80142593
    • DB-019143
    • STK375220
    • BBL002996
    • 211-822-6
    • Cyclohexylurea
    • MDL: MFCD00014286
    • Inchi: 1S/C7H14N2O/c8-7(10)9-6-4-2-1-3-5-6/h6H,1-5H2,(H3,8,9,10)
    • InChI Key: WUESWDIHTKHGQA-UHFFFAOYSA-N
    • SMILES: O=C(N)NC1CCCCC1
    • BRN: 0636914

Computed Properties

  • Exact Mass: 142.11100
  • Monoisotopic Mass: 142.110613
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 119
  • 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: 3
  • XLogP3: 0.5
  • Topological Polar Surface Area: 55.1

Experimental Properties

  • Color/Form: Powder.
  • Density: 1.05
  • Melting Point: 194-196°C
  • Boiling Point: 240.3 °C at 760 mmHg
  • Flash Point: 99.2 °C
  • Refractive Index: 1.5
  • PSA: 55.12000
  • LogP: 2.07860
  • Solubility: Not determined

Cyclohexylurea Security Information

  • Safety Instruction: S22-S24/25
  • RTECS:YS7564300
  • Safety Term:S22;S24/25

Cyclohexylurea Customs Data

  • HS CODE:2924299090
  • Customs Data:

    China Customs Code:

    2924299090

    Overview:

    2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, packing

    Summary:

    2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Cyclohexylurea Suppliers

Amadis Chemical Company Limited
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(CAS:698-90-8)Cyclohexylurea
Order Number:A836685
Stock Status:in Stock
Quantity:500g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 06:37
Price ($):473.0
Suzhou Senfeida Chemical Co., Ltd
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(CAS:698-90-8)Cyclohexylurea
Order Number:sfd19135
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:38
Price ($):discuss personally

Cyclohexylurea Related Literature

Additional information on Cyclohexylurea

Introduction to Cyclohexylurea (CAS No. 698-90-8)

Cyclohexylurea, with the chemical formula Cyclohexylurea and a CAS number of 698-90-8, is a significant compound in the field of organic chemistry and pharmaceutical research. This compound, characterized by its cyclohexyl group attached to a urea moiety, has garnered considerable attention due to its versatile applications and potential in various scientific domains.

The structural uniqueness of Cyclohexylurea lies in its ability to act as a versatile intermediate in the synthesis of more complex molecules. Its molecular structure, featuring a cyclohexyl ring linked to a urea functional group, makes it a valuable building block in the development of pharmaceuticals, agrochemicals, and specialty chemicals. The cyclohexyl group contributes to the compound's stability and reactivity, while the urea moiety provides additional functional sites for chemical modifications.

In recent years, research on Cyclohexylurea has expanded significantly, particularly in the context of drug discovery and development. The compound's ability to interact with biological targets has made it a subject of interest for designing novel therapeutic agents. For instance, studies have explored its potential as a precursor in the synthesis of urea-based drugs that exhibit antimicrobial and anti-inflammatory properties. These findings highlight the compound's significance in medicinal chemistry.

One of the most compelling aspects of Cyclohexylurea is its role in the development of advanced materials. Researchers have investigated its use in creating polymers and coatings with enhanced thermal stability and mechanical strength. The cyclohexyl group's contribution to these properties makes it an attractive candidate for industrial applications. Additionally, the compound's compatibility with various solvents and reagents enhances its utility in synthetic chemistry.

The pharmaceutical industry has also shown interest in Cyclohexylurea due to its potential as a lead compound for drug development. Its structural features allow for modifications that can fine-tune its biological activity. For example, derivatives of Cyclohexylurea have been studied for their potential in treating neurological disorders. The compound's ability to cross the blood-brain barrier has been particularly noted, making it a promising candidate for central nervous system (CNS) drug delivery systems.

Recent advancements in computational chemistry have further enhanced the understanding of Cyclohexylurea's properties. Molecular modeling studies have provided insights into how this compound interacts with biological targets at the molecular level. These studies have not only improved our understanding of its mechanism of action but also guided the design of more effective derivatives. The integration of computational methods with experimental techniques has been instrumental in uncovering new applications for Cyclohexylurea.

The agrochemical sector has also benefited from research on Cyclohexylurea. Its derivatives have been explored as potential intermediates in the synthesis of pesticides and herbicides. These compounds exhibit favorable properties such as high efficacy and low environmental impact, making them attractive for sustainable agriculture. The versatility of Cyclohexylurea as a building block has enabled the development of novel agrochemicals that meet modern agricultural demands.

In conclusion, Cyclohexylurea (CAS No. 698-90-8) is a multifaceted compound with significant applications across various scientific fields. Its unique structural features make it a valuable intermediate in pharmaceuticals, materials science, and agrochemicals. Ongoing research continues to uncover new possibilities for this compound, reinforcing its importance in modern chemistry and related industries.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:698-90-8)Cyclohexylurea
A836685
Purity:99%
Quantity:500g
Price ($):473.0
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Suzhou Senfeida Chemical Co., Ltd
(CAS:698-90-8)Cyclohexylurea
sfd19135
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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