1,3-Benzenedicarboxylic acid, polymer with 1,4-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate

CAS Registry Number®

68922-25-8

CAS Name

1,3-Benzenedicarboxylic acid, polymer with 1,4-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate

Molecular Formula

(C10H20O4.C9H4O5.C8H16O2.C8H6O4.C8H6O4.C5H12O2)x

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1,3-Benzenedicarboxylic acid, polymer with 1,4-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68922-25-8 (retrieved 2024-11-15) (CAS RN: 68922-25-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H20O4.C9H4O5.2C8H6O4.C8H16O2.C5H12O2/c1-9(2,5-11)7-14-8(13)10(3,4)6-12;10-7(11)4-1-2-5-6(3-4)9(13)14-8(5)12;9-7(10)5-1-2-6(4-3-5)8(11)12;9-7(10)5-2-1-3-6(4-5)8(11)12;9-5-7-1-2-8(6-10)4-3-7;1-5(2,3-6)4-7/h11-12H,5-7H2,1-4H3;1-3H,(H,10,11);2*1-4H,(H,9,10)(H,11,12);7-10H,1-6H2;6-7H,3-4H2,1-2H3

InChIKey

InChIKey=QBIAVLRBKKYZTR-UHFFFAOYSA-N

SMILES

C(OCC(CO)(C)C)(C(CO)(C)C)=O.O=C1C=2C(C(=O)O1)=CC=C(C(O)=O)C2.C(CO)(CO)(C)C.C(O)(=O)C1=CC(C(O)=O)=CC=C1.C(O)C1CCC(CO)CC1.C(O)(=O)C1=CC=C(C(O)=O)C=C1

Canonical SMILES

O=C(O)C1=CC=C(C=C1)C(=O)O.O=C(O)C1=CC=CC(=C1)C(=O)O.O=C(O)C1=CC=C2C(=O)OC(=O)C2=C1.O=C(OCC(C)(C)CO)C(C)(C)CO.OCC1CCC(CO)CC1.OCC(C)(C)CO

Other Names for this Substance

  • 1,3-Benzenedicarboxylic acid, polymer with 1,4-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate
  • 1,4-Benzenedicarboxylic acid, polymer with 1,3-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate
  • 1,4-Cyclohexanedimethanol, polymer with 1,3-benzenedicarboxylic acid, 1,4-benzenedicarboxylic acid, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate
  • 1,3-Propanediol, 2,2-dimethyl-, polymer with 1,3-benzenedicarboxylic acid, 1,4-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 1,3-dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate
  • 5-Isobenzofurancarboxylic acid, 1,3-dihydro-1,3-dioxo-, polymer with 1,3-benzenedicarboxylic acid, 1,4-benzenedicarboxylic acid, 1,4-cyclohexanedimethanol, 2,2-dimethyl-1,3-propanediol and 3-hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate

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