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Molecule
Bisphenol A-Carbonic Acid Copolymer
CAS: 25037-45-0 · C16H18O5
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 25037-45-0
- Molecular Formula
- C16H18O5
- Molecular Mass
- 290.32 g/mol
Identifiers
CAS Registry Number
25037-45-0
SMILES
CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.O=C(O)O
InChI Key
XSXWYGABGYBZRM-UHFFFAOYSA-N
InChI
InChI=1S/C15H16O2.CH2O3/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2-1(3)4/h3-10,16-17H,1-2H3;(H2,2,3,4)
Names and Synonyms
- Bisphenol A-Carbonic Acid Copolymer Common Name
- Carbonic acid, polymer with 4,4′-(1-methylethylidene)bis[phenol] Synonym
- Carbonic acid, polyester with 4,4′-isopropylidenediphenol Synonym
- Phenol, 4,4′-isopropylidenedi-, polyester with carbonic acid Synonym
- Phenol, 4,4′-(1-methylethylidene)bis-, polymer with carbonic acid Synonym
- Bisphenol A polycarbonate Synonym
- Poly(dian carbonate) Synonym
- 4,4′-Dihydroxydiphenyl-2,2-propane carbonate polymer Synonym
- Poly(bisphenol A carbonate) Synonym
- Carbonic acid-2,2′-bis(p-hydroxyphenyl)propane copolymer Synonym
- Bisphenol A-carbonic acid copolymer Synonym
- Bisphenol A carbonate polymer Synonym
- Bisphenol A-carbonic acid polymer Synonym
- Carbonic acid-isopropylidenediphenol polymer Synonym
- Carbonic acid-4,4′-isopropylidenediphenol polymer Synonym
- Poly[2,2-bis(4-hydroxyphenyl)propane carbonate] Synonym
- Carbonic acid-bisphenol A polymer Synonym
- Carbonic acid-2,2-bis(4-hydroxyphenyl)propane polymer Synonym
- 2,2-Bis(4-hydroxyphenyl)propane-carbonic acid polymer Synonym
- Carbonic acid-diphenylolpropane copolymer Synonym
- 2,2-Bis(4-hydroxyphenyl)propane-carbonic acid copolymer Synonym
- Carbonic acid-bisphenol A copolymer Synonym
- Carbonic acid-4,4′-dihydroxydiphenyl-2,2-propane copolymer Synonym
- Bisphenol A polycarbonate, monomer-based Synonym
- Makrofol DE, monomer-based Synonym
- Carbonic acid-4,4′-(1-methylethylidene)bis[phenol] copolymer Synonym
- Bisphenol A carbonate homopolymer Synonym
- SC 1100 Synonym
- Carbonic acid-2,2-di(4-hydroxyphenyl)propane copolymer Synonym
- Carbonic acid-2,2-bis-(4-hydroxyphenyl)propane copolymer Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 290.32 g/mol | CAS Common Chemistry |
| 290.315 g/mol | RDKit | |
| Density | 1.20 g/cm³ | CAS Common Chemistry |
| 1.20 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | O=C(O)O.OC1=CC=C(C=C1)C(C2=CC=C(O)C=C2)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C15H16O2.CH2O3/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2-1(3)4/h3-10,16-17H,1-2H3;(H2,2,3,4) | CAS Common Chemistry |
| InChI Key | InChIKey=XSXWYGABGYBZRM-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 197.7 °C | CAS Common Chemistry |
| Name | Bisphenol A-carbonic acid copolymer | CAS Common Chemistry |
| Heavy Atom Count | 21 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 97.99000000000001 Ų | RDKit |
| 97.99 Ų | RDKit | |
| LogP | 3.6461000000000015 | RDKit |
| 3.6461 | RDKit | |
| Molar Refractivity | 78.99520000000004 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.1875 | RDKit |
| 0.19 | chempirical lib | |
| Exact Mass | 290.115423676 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 290.32 g/mol; density = 1.200 g/mL. Edit any field — others recompute live.
