Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol and 2,2'-oxybis(ethanol)
[CAS# 34557-94-3]

Identification

• Name: Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol and 2,2'-oxybis(ethanol)
• Synonyms: Adipic Acid; 1,3-Diisocyanato-2-Methyl-Benzene; 2,4-Diisocyanato-1-Methyl-Benzene; 2-Ethyl-2-(Hydroxymethyl)Propane-1,3-Diol; 2-(2-Hydroxyethoxy)Ethanol; Adipic Acid
• Molecular Formula: C₃₄H₄₆N₄O₁₄
• Molecular Weight: 734.76
• CAS Registry Number: 34557-94-3
• SMILES: N(C1=CC=C(C(=C1)N=C=O)C)=C=O.N(C2=C(C(=CC=C2)N=C=O)C)=C=O.C(COCCO)O.C(C(CO)(CO)CC)O.C(C(=O)O)CCCC(=O)O
• InChI: 1S/2C9H6N2O2.C6H10O4.C6H14O3.C4H10O3/c1-7-2-3-8(10-5-12)4-9(7)11-6-13;1-7-8(10-5-12)3-2-4-9(7)11-6-13;7-5(8)3-1-2-4-6(9)10;1-2-6(3-7,4-8)5-9;5-1-3-7-4-2-6/h2*2-4H,1H3;1-4H2,(H,7,8)(H,9,10);7-9H,2-5H2,1H3;5-6H,1-4H2
• InChIKey: LBGAXMAWJPXYPD-UHFFFAOYSA-N

Properties

• Boiling point: 251°C at 760 mmHg (Cal.)
• Flash point: 110.5°C (Cal.)