(2S)-2-(Dodecoxycarbonylamino)-3-Methylbutanoic Acid
[CAS# 158961-81-0]

Identification

• Name: (2S)-2-(Dodecoxycarbonylamino)-3-Methylbutanoic Acid
• Synonyms: (2S)-2-(Dodecoxycarbonylamino)-3-Methyl-Butanoic Acid; (2S)-2-[(Dodecoxy-Oxomethyl)Amino]-3-Methylbutanoic Acid; (2S)-2-(Lauryloxycarbonylamino)-3-Methyl-Butyric Acid
• Molecular Formula: C₁₈H₃₅NO₄
• Molecular Weight: 329.48
• CAS Registry Number: 158961-81-0
• SMILES: [C@@H](NC(OCCCCCCCCCCCC)=O)(C(=O)O)C(C)C
• InChI: 1S/C18H35NO4/c1-4-5-6-7-8-9-10-11-12-13-14-23-18(22)19-16(15(2)3)17(20)21/h15-16H,4-14H2,1-3H3,(H,19,22)(H,20,21)/t16-/m0/s1
• InChIKey: KFXDHGFKZUDVAR-INIZCTEOSA-N

Properties

• Density: 0.988g/cm³ (Cal.)
• Boiling point: 460.25°C at 760 mmHg (Cal.)
• Flash point: 232.151°C (Cal.)