1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid
Basic information
- CAS
26141-00-4- Standard SMILES
CC(C)(CO)CO.O=C(O)CCCCC(=O)O.O=C(O)c1cccc(C(=O)O)c1- InChIKey
OIRRHEVEVMPUTD-UHFFFAOYSA-N- Molecular formula
- C19H28O10
- Average molar mass
- 416.4 g/mol
Names & identifiers
- Preferred name
- 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid
- IUPAC
- benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexanedioic acid
- English name
- 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid
- Molecular formula
- C19H28O10
- Molecular weight
- 416.41962
Names & synonyms
Adipic acid, isophthalic acid, neopentyl glycol resinRefChem:413426DTXSID901012075SCHEMBL31597132OIRRHEVEVMPUTD-UHFFFAOYSA-NAdipic acid, isophthalic acid, neopentyl glycol polymer1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid
Database identifiers
- CAS
26141-00-4- PubChem CID
- 168488
Properties
Computed structural properties
- Topological polar surface area
- 190 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 337
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid (26141-00-4)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
Chemical: 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid
FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used.
1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid: Human health tier I assessment
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol and hexanedioic acid: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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