Hexanedioic acid, polymer with butanediol, 1,4-butanediol and 1,1'-methylenebis(4-isocyanatobenzene)
[CAS 58180-53-3]

Identification

• Name: Hexanedioic acid, polymer with butanediol, 1,4-butanediol and 1,1'-methylenebis(4-isocyanatobenzene)
• Synonyms: Adipic Acid; Butane-1,1-Diol; Butane-1,4-Diol; 1-Isocyanato-4-[(4-Isocyanatophenyl)Methyl]Benzene; Adipic Acid; Butane-1,1-Diol
• Molecular Formula: C₂₉H₄₀N₂O₁₀
• Molecular Weight: 576.64
• CAS Registry Number: 58180-53-3
• SMILES: O=C=NC2=CC=C(CC1=CC=C(C=C1)N=C=O)C=C2.C(CCCO)O.C(C(O)O)CC.C(C(=O)O)CCCC(=O)O
• InChI: 1S/C15H10N2O2.C6H10O4.2C4H10O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;7-5(8)3-1-2-4-6(9)10;1-2-3-4(5)6;5-3-1-2-4-6/h1-8H,9H2;1-4H2,(H,7,8)(H,9,10);4-6H,2-3H2,1H3;5-6H,1-4H2
• InChIKey: VVXQIZIMUGBDHA-UHFFFAOYSA-N

Properties

• Boiling point: 373.4°C at 760 mmHg (Cal.)
• Flash point: 154°C (Cal.)