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Hexanedioic Acid, Polymer With 1,6-Hexanediol
Also known as: 25212-06-0, Hexanedioic acid;hexane-1,6-diol, Hexanediol, adipic acid polymer, Adipic acid, 1,6-hexanediol polymer, 1,6-hexanediol, adipic acid copolymer, 1,6-hexanediol, adipic acid polyester
Molecular Formula
C12H24O6
Molecular Weight
264.31  g/mol
InChI Key
WPEOOEIAIFABQP-UHFFFAOYSA-N

1 2D Structure

Hexanedioic Acid, Polymer With 1,6-Hexanediol

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
hexanedioic acid;hexane-1,6-diol
2.1.2 InChI
InChI=1S/C6H10O4.C6H14O2/c7-5(8)3-1-2-4-6(9)10;7-5-3-1-2-4-6-8/h1-4H2,(H,7,8)(H,9,10);7-8H,1-6H2
2.1.3 InChI Key
WPEOOEIAIFABQP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C(CCCO)CCO.C(CCC(=O)O)CC(=O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 25212-06-0

2. Hexanedioic Acid;hexane-1,6-diol

3. Hexanediol, Adipic Acid Polymer

4. Adipic Acid, 1,6-hexanediol Polymer

5. 1,6-hexanediol, Adipic Acid Copolymer

6. 1,6-hexanediol, Adipic Acid Polyester

7. Adipic Acid, 1,6-hexanediol Polyester

8. 1,6-hexanediol, Hexanedioic Acid Polymer

9. Hexanedioic Acid, 1,6-hexanediol Polymer

10. Hexane-1,6-diol Adipate

11. Schembl597587

2.3 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 264.31 g/mol
Molecular Formula C12H24O6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass264.15728848 g/mol
Monoisotopic Mass264.15728848 g/mol
Topological Polar Surface Area115 Ų
Heavy Atom Count18
Formal Charge0
Complexity145
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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