6-[(7-Methyloctanoyl)amino]hexanoic acid - 2,2',2''-nitrilotriethanol (1:1)
[CAS# 85702-79-0]

Identification

• Name: 6-[(7-Methyloctanoyl)amino]hexanoic acid - 2,2',2''-nitrilotriethanol (1:1)
• Synonyms: 6-(Isononanoylamino)hexanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)
• Molecular Formula: C₂₁H₄₄N₂O₆
• Molecular Weight: 420.58
• CAS Registry Number: 85702-79-0
• EINECS: 288-270-8
• SMILES: O=C(NCCCCCC(=O)O)CCCCCC(C)C.OCCN(CCO)CCO
• InChI: 1S/C15H29NO3.C6H15NO3/c1-13(2)9-5-3-6-10-14(17)16-12-8-4-7-11-15(18)19;8-4-1-7(2-5-9)3-6-10/h13H,3-12H2,1-2H3,(H,16,17)(H,18,19);8-10H,1-6H2
• InChIKey: FKSJFWVVZWWJJB-UHFFFAOYSA-N

Properties

• Boiling point: 462.8°C at 760 mmHg (Cal.)
• Flash point: 233.7°C (Cal.)