CAS
10602-08-1 Purity
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10602-08-1 Purity
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Specification
The molecular formula is C13H10O.
The molecular weight is 182.22 g/mol.
The IUPAC name is 2-ethynyl-6-methoxynaphthalene.
The InChI is InChI=1S/C13H10O/c1-3-10-4-5-12-9-13(14-2)7-6-11(12)8-10/h1,4-9H,2H3.
The InChIKey is PATPLTUFXUXNDY-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC2=C(C=C1)C=C(C=C2)C#C.
The CAS number is 129113-00-4.
The XLogP3 value is 3.4.
It has 0 hydrogen bond donor count.
It has 1 hydrogen bond acceptor count.