Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene and 1,6-hexanediol
[CAS# 9068-96-6]

Identification

• Name: Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene and 1,6-hexanediol
• Synonyms: Adipic Acid; 1,3-Diisocyanato-2-Methyl-Benzene; Hexane-1,6-Diol; Adipic Acid; 1,3-Diisocyanato-2-Methylbenzene; Hexane-1,6-Diol
• Molecular Formula: C₂₁H₃₀N₂O₈
• Molecular Weight: 438.48
• CAS Registry Number: 9068-96-6
• SMILES: O=C=NC1=C(C(=CC=C1)N=C=O)C.C(CCCCCO)O.C(C(=O)O)CCCC(=O)O
• InChI: 1S/C9H6N2O2.C6H10O4.C6H14O2/c1-7-8(10-5-12)3-2-4-9(7)11-6-13;7-5(8)3-1-2-4-6(9)10;7-5-3-1-2-4-6-8/h2-4H,1H3;1-4H2,(H,7,8)(H,9,10);7-8H,1-6H2
• InChIKey: XTKYFNKPSZVLMO-UHFFFAOYSA-N

Properties

• Boiling point: 248.4°C at 760 mmHg (Cal.)
• Flash point: 110.5°C (Cal.)