Decanedioic acid, polymer with azacyclotridecan-2-one, hexahydro-2H-azepin-2-one, 1,6-hexanediamine and hexanedioic acid
[CAS# 55398-96-4]

Identification

• Name: Decanedioic acid, polymer with azacyclotridecan-2-one, hexahydro-2H-azepin-2-one, 1,6-hexanediamine and hexanedioic acid
• Synonyms: Adipic Acid; 1-Azacyclotridecan-2-One; Azepan-2-One; Decanedioic Acid; Hexane-1,6-Diamine; Adipic Acid
• Molecular Formula: C₄₀H₇₈N₄O₁₀
• Molecular Weight: 775.08
• CAS Registry Number: 55398-96-4
• SMILES: O=C1NCCCCC1.C2C(=O)NCCCCCCCCCC2.C(C(=O)O)CCCC(=O)O.C(C(=O)O)CCCCCCCC(=O)O.C(CCCN)CCN
• InChI: 1S/C12H23NO.C10H18O4.C6H16N2.C6H11NO.C6H10O4/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-12;11-9(12)7-5-3-1-2-4-6-8-10(13)14;7-5-3-1-2-4-6-8;8-6-4-2-1-3-5-7-6;7-5(8)3-1-2-4-6(9)10/h1-11H2,(H,13,14);1-8H2,(H,11,12)(H,13,14);1-8H2;1-5H2,(H,7,8);1-4H2,(H,7,8)(H,9,10)
• InChIKey: QGQBVBDOSFWAFL-UHFFFAOYSA-N

Properties

• Boiling point: 314.9°C at 760 mmHg (Cal.)
• Flash point: 188.1°C (Cal.)