Cas no 1261984-36-4 (2-3-(N,N-Dimethylaminocarbonyl)phenylphenol)

2-3-(N,N-Dimethylaminocarbonyl)phenylphenol is a specialized organic compound featuring a phenol group linked to a phenyl ring substituted with an N,N-dimethylaminocarbonyl moiety. This structure imparts unique reactivity and solubility properties, making it valuable in synthetic chemistry applications, particularly as an intermediate in pharmaceuticals or agrochemicals. The dimethylaminocarbonyl group enhances electron density, influencing its participation in coupling or condensation reactions. Its balanced polarity allows for versatility in both aqueous and organic solvents, facilitating diverse reaction conditions. The compound’s stability under moderate temperatures further supports its utility in multi-step syntheses. Careful handling is advised due to potential sensitivity to strong acids or bases.
2-3-(N,N-Dimethylaminocarbonyl)phenylphenol structure
1261984-36-4 structure
Product Name:2-3-(N,N-Dimethylaminocarbonyl)phenylphenol
CAS No:1261984-36-4
MF:C15H15NO2
MW:241.285104036331
MDL:MFCD18312954
CID:1037884
PubChem ID:53218651
Update Time:2025-05-21

2-3-(N,N-Dimethylaminocarbonyl)phenylphenol Chemical and Physical Properties

Names and Identifiers

    • 2'-Hydroxy-N,N-dimethyl-[1,1'-biphenyl]-3-carboxamide
    • 3-(2-hydroxyphenyl)-N,N-dimethylbenzamide
    • 1261984-36-4
    • DTXSID90683568
    • MFCD18312954
    • SB77231
    • 2-[3-(N,N-DIMETHYLAMINOCARBONYL)PHENYL]PHENOL
    • [1,1'-Biphenyl]-3-carboxamide, 2'-hydroxy-N,N-dimethyl-
    • BS-20357
    • 2'-Hydroxy-N,N-dimethyl[1,1'-biphenyl]-3-carboxamide
    • 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol
    • MDL: MFCD18312954
    • Inchi: 1S/C15H15NO2/c1-16(2)15(18)12-7-5-6-11(10-12)13-8-3-4-9-14(13)17/h3-10,17H,1-2H3
    • InChI Key: WCASFNPWKFUQAP-UHFFFAOYSA-N
    • SMILES: OC1C=CC=CC=1C1=CC=CC(C(N(C)C)=O)=C1

Computed Properties

  • Exact Mass: 241.11000
  • Monoisotopic Mass: 241.110278721g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 290
  • 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
  • XLogP3: 2.7
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • PSA: 40.54000
  • LogP: 2.76100

2-3-(N,N-Dimethylaminocarbonyl)phenylphenol 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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Additional information on 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol

2-3-(N,N-Dimethylaminocarbonyl)phenylphenol: A Comprehensive Overview

The compound 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol (CAS No. 1261984-36-4) is a highly specialized organic compound with significant applications in various fields, including materials science and biomedicine. This compound is characterized by its unique chemical structure, which combines a phenolic group with an N,N-dimethylaminocarbonyl substituent. The N,N-dimethylaminocarbonyl group imparts distinctive electronic and steric properties to the molecule, making it versatile for different chemical reactions and applications.

Recent studies have highlighted the potential of 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol in advanced materials development. Researchers have explored its role as a precursor in the synthesis of novel polymers and hybrid materials. For instance, its ability to form stable covalent bonds under specific reaction conditions has been leveraged to create high-performance polymers with enhanced thermal stability and mechanical strength. These findings underscore the importance of this compound in driving innovation in materials science.

In the field of biomedicine, 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol has shown promise as a drug delivery agent. Its unique structure allows for the conjugation of bioactive molecules, enabling targeted drug delivery systems. Recent experiments have demonstrated its effectiveness in encapsulating hydrophobic drugs, improving their solubility and bioavailability. This application is particularly significant in the development of nanomedicine and personalized treatment strategies.

The synthesis of 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol involves a multi-step process that typically begins with the preparation of the phenolic precursor. The introduction of the N,N-dimethylaminocarbonyl group is achieved through nucleophilic substitution or coupling reactions, depending on the specific conditions required. Researchers have optimized these reaction conditions to achieve high yields and purity levels, ensuring the compound's suitability for various applications.

From a structural perspective, 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol consists of a benzene ring substituted with a hydroxyl group at position 2 and an N,N-dimethylaminocarbonyl group at position 3. The spatial arrangement of these substituents plays a crucial role in determining the compound's reactivity and functionality. The phenolic group provides acidic properties, while the N,N-dimethylaminocarbonyl group contributes to the molecule's basicity and nucleophilic character.

Recent advancements in computational chemistry have provided deeper insights into the electronic structure of 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol. Quantum mechanical calculations have revealed that the molecule exhibits significant conjugation effects due to the resonance between the phenolic oxygen and the carbonyl group. This conjugation enhances the compound's stability and reactivity, making it an attractive candidate for use in various chemical transformations.

In terms of physical properties, 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol is typically a white crystalline solid with a melting point of approximately 150°C under standard conditions. Its solubility in organic solvents such as dichloromethane and THF is relatively high, facilitating its use in solution-based reactions. However, it exhibits limited solubility in water due to its hydrophobic nature.

The application of 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol extends beyond materials science and biomedicine into areas such as catalysis and sensor technology. Recent studies have demonstrated its potential as a ligand in metalloorganic catalysts, where it enhances catalytic activity by stabilizing metal centers through coordination interactions. Additionally, its ability to respond to external stimuli such as pH changes makes it a candidate for use in smart sensors for environmental monitoring.

Despite its wide-ranging applications, the synthesis and handling of 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol require careful consideration of safety protocols. The compound should be stored in dry conditions to prevent hydrolysis and should be handled using appropriate personal protective equipment (PPE). Its stability under thermal and oxidative conditions has been thoroughly investigated, ensuring safe usage across various industrial processes.

In conclusion, 2-3-(N,N-Dimethylaminocarbonyl)phenylphenol (CAS No. 1261984-36-4) is a versatile compound with significant potential in multiple scientific domains. Its unique structure enables diverse applications ranging from advanced materials development to biomedical innovations. As research continues to uncover new properties and uses for this compound, it is poised to play an increasingly important role in both academic and industrial settings.

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