Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, 2-methyloxirane, oxirane and sodium sulfite (1:1)

CAS Registry Number®

129731-08-4

CAS Name

Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, 2-methyloxirane, oxirane and sodium sulfite (1:1)

Molecular Formula

(C12H18N2O2.C10H22N2.C8H12N2O2.C6H14O2.C6H10O4.C5H12O2.C3H6O.C2H4O.H2O3S.Na)x

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Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, 2-methyloxirane, oxirane and sodium sulfite (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=129731-08-4 (retrieved 2024-11-24) (CAS RN: 129731-08-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H18N2O2.C10H22N2.C8H12N2O2.C6H10O4.C6H14O2.C5H12O2.C3H6O.C2H4O.Na.H2O3S/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15;1-9(2)4-8(12)5-10(3,6-9)7-11;11-7-9-5-3-1-2-4-6-10-8-12;7-5(8)3-1-2-4-6(9)10;7-5-3-1-2-4-6-8;1-5(2,3-6)4-7;1-3-2-4-3;1-2-3-1;;1-4(2)3/h10H,4-7H2,1-3H3;8H,4-7,11-12H2,1-3H3;1-6H2;1-4H2,(H,7,8)(H,9,10);7-8H,1-6H2;6-7H,3-4H2,1-2H3;3H,2H2,1H3;1-2H2;;(H2,1,2,3)

InChIKey

InChIKey=ACGAHDSFLQLOJK-UHFFFAOYSA-N

SMILES

S(=O)(O)O.[Na].C(N=C=O)C1(C)CC(N=C=O)CC(C)(C)C1.C(N)C1(C)CC(C)(C)CC(N)C1.C(CCCN=C=O)CCN=C=O.C(CCCO)CCO.C(CO)(CO)(C)C.C(CCC(O)=O)CC(O)=O.CC1CO1.C1CO1

Canonical SMILES

[Na].O=C=NCCCCCCN=C=O.O=C=NCC1(C)CC(N=C=O)CC(C)(C)C1.O=C(O)CCCCC(=O)O.O=S(O)O.OCCCCCCO.OCC(C)(C)CO.O1CC1.O1CC1C.NCC1(C)CC(N)CC(C)(C)C1

Other Names for this Substance

  • Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, 2-methyloxirane, oxirane and sodium sulfite (1:1)
  • Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, methyloxirane, oxirane and sodium hydrogen sulfite
  • Oxirane, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, methyloxirane and sodium hydrogen sulfite
  • Oxirane, methyl-, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, 2,2-dimethyl-1,3-propanediol, hexanedioic acid, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, oxirane and sodium hydrogen sulfite
  • 1,3-Propanediol, 2,2-dimethyl-, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,6-diisocyanatohexane, hexanedioic acid, 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, methyloxirane, oxirane and sodium hydrogen sulfite

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