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2-Methyl-N-Octanoylalanine
[CAS# 176664-71-4]

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Identification
Name 2-Methyl-N-Octanoylalanine
Synonyms 2-methyl-2-octanamidopropanoic acid
Molecular Structure CAS#: 176664-71-4, 2-Methyl-N-Octanoylalanine
Molecular Formula C12H23NO3
Molecular Weight 229.32
CAS Registry Number 176664-71-4
SMILES CCCCCCCC(=O)NC(C)(C)C(=O)O
InChI 1S/C12H23NO3/c1-4-5-6-7-8-9-10(14)13-12(2,3)11(15)16/h4-9H2,1-3H3,(H,13,14)(H,15,16)
InChIKey PLXBHAOFRHUTEU-UHFFFAOYSA-N
Properties
Density 1.009g/cm3 (Cal.)
Boiling point 411.3°C at 760 mmHg (Cal.)
Flash point 202.547°C (Cal.)
Refractive index 1.465 (Cal.)
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