2-(3-Methylpent-1-Yn-3-Yloxycarbonyl)Benzoic Acid
[CAS# 131-67-9]

Identification

• Name: 2-(3-Methylpent-1-Yn-3-Yloxycarbonyl)Benzoic Acid
• Synonyms: 2-(1-Ethyl-1-Methyl-Prop-2-Ynoxy)Carbonylbenzoic Acid; 2-[(1-Ethyl-1-Methylprop-2-Ynoxy)-Oxomethyl]Benzoic Acid; 3-Methyl-1-Pentyn-3-Yl Acid Phthalate
• Molecular Formula: C₁₄H₁₄O₄
• Molecular Weight: 246.26
• CAS Registry Number: 131-67-9
• SMILES: C1=CC=CC(=C1C(OC(CC)(C#C)C)=O)C(O)=O
• InChI: 1S/C14H14O4/c1-4-14(3,5-2)18-13(17)11-9-7-6-8-10(11)12(15)16/h1,6-9H,5H2,2-3H3,(H,15,16)
• InChIKey: CZGIRAWWWHPJHM-UHFFFAOYSA-N