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Chemistry

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Also known as: Pvap, 34481-48-6, Ethenyl acetate;phthalic acid, 53237-50-6, Unii-58qvg85gw3, Polyvinyl acetate phthalate [nf]
Molecular Formula
C12H12O6
Molecular Weight
252.22  g/mol
InChI Key
LUJQXGBDWAGQHS-UHFFFAOYSA-N

Polyvinyl Acetate Phthalate
1 2D Structure

Polyvinyl Acetate Phthalate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
ethenyl acetate;phthalic acid
2.1.2 InChI
InChI=1S/C8H6O4.C4H6O2/c9-7(10)5-3-1-2-4-6(5)8(11)12;1-3-6-4(2)5/h1-4H,(H,9,10)(H,11,12);3H,1H2,2H3
2.1.3 InChI Key
LUJQXGBDWAGQHS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(=O)OC=C.C1=CC=C(C(=C1)C(=O)O)C(=O)O
2.2 Synonyms
2.2.1 MeSH Synonyms

1. Polyvinylacetate Phthalate Polymer

2. Pvap

2.2.2 Depositor-Supplied Synonyms

1. Pvap

2. 34481-48-6

3. Ethenyl Acetate;phthalic Acid

4. 53237-50-6

5. Unii-58qvg85gw3

6. Polyvinyl Acetate Phthalate [nf]

7. Polyvinylacetate Phthalate Polymer

8. Schembl3106

9. 58qvg85gw3

10. 1,2-benzenedicarboxylic Acid, Polymer With Ethenyl Acetate

11. Dtxsid40956012

12. Ethenol, Homopolymer, Acetate 1,2-benzenedicarboxylate

13. Benzene-1,2-dicarboxylic Acid--ethenyl Acetate (1/1)

2.3 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 252.22 g/mol
Molecular Formula C12H12O6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass252.06338810 g/mol
Monoisotopic Mass252.06338810 g/mol
Topological Polar Surface Area101 Ų
Heavy Atom Count18
Formal Charge0
Complexity243
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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