Cas no 79259-56-6 (BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]-)

Technical Introduction: BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]- is an aromatic amine derivative featuring an ethynyl linkage to a 4-methylphenyl group. This compound is of interest in organic synthesis due to its conjugated structure, which may enhance electronic properties for applications in materials science, such as conductive polymers or optoelectronic devices. The presence of the ethynyl group offers reactivity for further functionalization via Sonogashira or click chemistry, while the amine moiety provides a site for derivatization or coordination. Its structural features make it a potential intermediate for pharmaceuticals, agrochemicals, or advanced materials, combining stability with versatile reactivity.
BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]- structure
79259-56-6 structure
Product Name:BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]-
CAS No:79259-56-6
MF:C15H13N
MW:207.270423650742
CID:3360053
PubChem ID:12168184
Update Time:2025-06-06

BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]- Chemical and Physical Properties

Names and Identifiers

    • BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]-
    • Benzenamine, 3-[2-(4-methylphenyl)ethynyl]-
    • SCHEMBL11009539
    • MFCD12156101
    • 3-(4'-methyl-phenyl-ethynyl)-aniline
    • 3-[2-(4-methylphenyl)ethynyl]aniline
    • 79259-56-6
    • 3-p-tolylethynyl-phenylamine
    • 3-p-Tolylethynyl-phenylamine, 97%
    • HTVWGZXFRJJGDL-UHFFFAOYSA-N
    • 3-(p-Tolylethynyl)aniline
    • 3-(4'-methyl-phenyl-ethynyl)aniline
    • Inchi： 1S/C15H13N/c1-12-5-7-13(8-6-12)9-10-14-3-2-4-15(16)11-14/h2-8,11H,16H2,1H3
    • InChI Key： HTVWGZXFRJJGDL-UHFFFAOYSA-N
    • SMILES： C1(N)=CC=CC(C#CC2=CC=C(C)C=C2)=C1

Computed Properties

  • Exact Mass: 207.104799419Da
  • Monoisotopic Mass: 207.104799419Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 274
  • 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: 3.4
  • Topological Polar Surface Area: 26?2

BENZENAMINE, 3-[(4-METHYLPHENYL)ETHYNYL]- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
A2B Chem LLC
BA28319-1g
3-p-Tolylethynyl-phenylamine
 79259-56-6 97%
1g
 $993.00 2024-04-19
A2B Chem LLC
BA28319-5g
3-p-Tolylethynyl-phenylamine
 79259-56-6 97%
5g
 $2523.00 2024-04-19
abcr
AB570962-1g
3-p-Tolylethynyl-phenylamine, 97%; .
 79259-56-6 97%
1g
 €1285.20 2025-04-16

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