2-(4-Methoxy-Benzoylamino)-3-Methyl-Butyric Acid
[CAS# 93709-65-0]

Identification

• Name: 2-(4-Methoxy-Benzoylamino)-3-Methyl-Butyric Acid
• Synonyms: (2S)-2-[(4-Methoxybenzoyl)Amino]-3-Methyl-Butanoate; (2S)-2-[[(4-Methoxyphenyl)-Oxomethyl]Amino]-3-Methylbutanoate; (2S)-2-[(4-Methoxybenzoyl)Amino]-3-Methyl-Butyrate
• Molecular Formula: C₁₃H₁₆NO₄
• Molecular Weight: 250.27
• CAS Registry Number: 93709-65-0
• SMILES: [C@@H](NC(=O)C1=CC=C(OC)C=C1)(C([O-])=O)C(C)C
• InChI: 1S/C13H17NO4/c1-8(2)11(13(16)17)14-12(15)9-4-6-10(18-3)7-5-9/h4-8,11H,1-3H3,(H,14,15)(H,16,17)/p-1/t11-/m0/s1
• InChIKey: GCNXSZNMYYPFGF-NSHDSACASA-M

Properties

• Boiling point: 463.053°C at 760 mmHg (Cal.)
• Flash point: 233.846°C (Cal.)