3-Ethynylanisole

• CAS: 768-70-7
• Catalog Number: ACM768707
• Category: Other Products
• Molecular Weight: 132.16
• Molecular Formula: C9H8O
• Synonyms: 3-Ethynylanisole, 1-ethynyl-3-methoxybenzene, 768-70-7, 3-Methoxyphenylacetylene, 1-Ethynyl-3-methoxy-Benzene, 3-ethynyl-1-methoxybenzene, benzene, 1-ethynyl-3-methoxy-, SBB068486, AG-H-07001, 3-ethynyl-anisole, AC1LD1EF, AC1Q4DWS, 1-Etynyl-3-Methoxy-Benzene, KSC643K2L, Benzene,1-ethynyl-3-methoxy-, 519413_ALDRICH, CHEMBL1288325, CTK5E3525, MolPort-001-769-352, ACT00933
• IUPAC Name: 1-ethynyl-3-methoxybenzene
• SMILES: COC1=CC=CC(=C1)C#C
• InChI Key: ZASXCTCNZKFDTP-UHFFFAOYSA-N
• Boiling Point: 204.4 °C at 760 mmHg
• Flash Point: 77ºC
• Density: 1.04
• Exact Mass: 132.05800
• H-Bond Acceptor: 1
• H-Bond Donor: 0

Synthetic Use

Upstream Synthesis Route 1

• 253684-23-0

• 768-70-7

Reference: [1] Tetrahedron Letters, 2011, vol. 52, # 9, p. 992 - 994
[2] Organic Letters, 2009, vol. 11, # 1, p. 229 - 231
[3] Advanced Synthesis and Catalysis, 2015, vol. 357, # 2-3, p. 553 - 560
[4] Bioorganic and Medicinal Chemistry Letters, 2015, vol. 25, # 22, p. 5127 - 5132
[5] Heterocyclic Communications, 2016, vol. 22, # 3, p. 165 - 167

Upstream Synthesis Route 2

• 40230-92-0

• 768-70-7

Reference: [1] Tetrahedron Letters, 1995, vol. 36, # 33, p. 5891 - 5894

Upstream Synthesis Route 3

• 586-37-8

• 768-70-7

Reference: [1] Synlett, 2009, # 4, p. 558 - 561

Upstream Synthesis Route 4

• 40230-92-0

• 768-70-7

Reference: [1]Tetrahedron Letters,1995,vol. 36,p. 5891 - 5894