Cas no 1261891-56-8 (5-(4-Chloro-3-methylphenyl)-2-cyanophenol)

5-(4-Chloro-3-methylphenyl)-2-cyanophenol is a specialized organic compound featuring a phenol core substituted with a cyano group at the 2-position and a 4-chloro-3-methylphenyl moiety at the 5-position. This structure imparts unique reactivity, making it a valuable intermediate in synthetic organic chemistry, particularly for pharmaceuticals and agrochemicals. The chloro and methyl substituents enhance its potential for further functionalization, while the cyano group offers versatility in coupling reactions. Its well-defined molecular architecture ensures consistent performance in complex synthetic pathways. The compound is typically handled under controlled conditions due to its reactivity, and its purity is critical for applications requiring precise chemical transformations.
5-(4-Chloro-3-methylphenyl)-2-cyanophenol structure
1261891-56-8 structure
Product Name:5-(4-Chloro-3-methylphenyl)-2-cyanophenol
CAS No:1261891-56-8
MF:C14H10ClNO
MW:243.688302516937
MDL:MFCD18314358
CID:2761627
PubChem ID:53220033
Update Time:2025-05-27

5-(4-Chloro-3-methylphenyl)-2-cyanophenol Chemical and Physical Properties

Names and Identifiers

    • MFCD18314358
    • 5-(4-Chloro-3-methylphenyl)-2-cyanophenol, 95%
    • 5-(4-CHLORO-3-METHYLPHENYL)-2-CYANOPHENOL
    • 4'-Chloro-3-hydroxy-3'-methyl[1,1'-biphenyl]-4-carbonitrile
    • DTXSID90684813
    • 1261891-56-8
    • 5-(4-Chloro-3-methylphenyl)-2-cyanophenol
    • MDL: MFCD18314358
    • Inchi: 1S/C14H10ClNO/c1-9-6-10(4-5-13(9)15)11-2-3-12(8-16)14(17)7-11/h2-7,17H,1H3
    • InChI Key: RCWPFAPYMBGYHZ-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1C)C1C=CC(C#N)=C(C=1)O

Computed Properties

  • Exact Mass: 243.0450916Da
  • Monoisotopic Mass: 243.0450916Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 311
  • 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: 4.5
  • Topological Polar Surface Area: 44?2

5-(4-Chloro-3-methylphenyl)-2-cyanophenol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB320401-5 g
5-(4-Chloro-3-methylphenyl)-2-cyanophenol, 95%; .
1261891-56-8 95%
5g
€1,159.00 2022-08-31
abcr
AB320401-5g
5-(4-Chloro-3-methylphenyl)-2-cyanophenol, 95%; .
1261891-56-8 95%
5g
€1159.00 2024-04-20
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