Cas no 486406-54-6 (4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol)

4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol is a tertiary acetylenic alcohol featuring a dimethylphenyl substituent. This compound is characterized by its stable alkyne functionality and sterically hindered hydroxyl group, making it useful as an intermediate in organic synthesis. Its structure allows for selective reactivity in coupling and addition reactions, while the aromatic dimethyl groups enhance solubility in nonpolar solvents. The compound is particularly valued in fine chemical and pharmaceutical applications where controlled functionalization is required. Its stability under standard conditions and compatibility with various catalysts further contribute to its utility in specialized synthetic routes. Proper handling should account for its flammability and potential irritant properties.
4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol structure
486406-54-6 structure
Product Name:4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol
CAS No:486406-54-6
MF:C13H16O
MW:188.265543937683
MDL:MFCD22124106
CID:1085007
PubChem ID:21357719
Update Time:2025-10-17

4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol Chemical and Physical Properties

Names and Identifiers

    • 4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol
    • 4-(3,5-dimethylphenyl)-2-methyl-but-3-yn-2-ol
    • [1,1'-Biphenyl]-4-carboxylic acid, 3-chloro-3',5'-dimethyl-
    • 3-Chloro-3',5'-dimethyl-[1,1'-biphenyl]-4-carboxylic acid
    • 4-(3',5'-dimethylphenyl)-2-chlorobenzoic acid
    • ACMC-209qt2
    • AGN-PC-00C53Z
    • ANW-39012
    • CTK2I1503
    • MFCD22124106
    • 486406-54-6
    • 4-(3,5-Dimethyl-phenyl)-2-methyl-but-3-yn-2-ol
    • 4-(3,5-Dimethyl-phenyl)-2-methyl-but-3-yn-2-ol, 97%
    • MDL： MFCD22124106
    • Inchi： 1S/C13H16O/c1-10-7-11(2)9-12(8-10)5-6-13(3,4)14/h7-9,14H,1-4H3
    • InChI Key： MJUDSXDVRLWTMT-UHFFFAOYSA-N
    • SMILES： OC(C#CC1C=C(C)C=C(C)C=1)(C)C

Computed Properties

  • Exact Mass: 188.120115130g/mol
  • Monoisotopic Mass: 188.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 243
  • 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: 20.2?2

4-(3,5-Dimethylphenyl)-2-methylbut-3-yn-2-ol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB570773-1 g
4-(3,5-Dimethyl-phenyl)-2-methyl-but-3-yn-2-ol, 97%; .
 486406-54-6 97%
1g
 €1,338.30 2023-07-11
abcr
AB570773-1g
4-(3,5-Dimethyl-phenyl)-2-methyl-but-3-yn-2-ol, 97%; .
 486406-54-6 97%
1g
 €1285.20 2025-03-19
A2B Chem LLC
BA19767-1g
4-(3,5-Dimethyl-phenyl)-2-methyl-but-3-yn-2-ol
 486406-54-6 97%
1g
 $993.00 2024-04-19
A2B Chem LLC
BA19767-5g
4-(3,5-Dimethyl-phenyl)-2-methyl-but-3-yn-2-ol
 486406-54-6 97%
5g
 $2523.00 2024-04-19

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