1-Ethynyl-2-methoxynaphthalene

Base Information

• Chemical Name: 1-Ethynyl-2-methoxynaphthalene
• CAS No.: 917894-85-0
• Molecular Formula: C13H10O
• Molecular Weight: 182.222
• DSSTox Substance ID: DTXSID40700678
• Nikkaji Number: J2.749.393I
• Wikidata: Q82632115

Synonyms:1-ETHYNYL-2-METHOXYNAPHTHALENE;917894-85-0;Naphthalene, 1-ethynyl-2-methoxy-;1-ethinyl-2-methoxynaphthalene;SCHEMBL12988355;DTXSID40700678;AKOS006240465;EN300-258579

Chemical Property of 1-Ethynyl-2-methoxynaphthalene

Chemical Property:

• PSA: 9.23000
• LogP: 2.82970
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 182.073164938
• Heavy Atom Count: 14
• Complexity: 237

Purity/Quality:

97% ^*data from raw suppliers

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MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C2=CC=CC=C2C=C1)C#C

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