Basic information
- CAS
79720-88-0- Standard SMILES
C=CC(=O)O.C=CC(=O)O.CCC(CO)(CO)CO.O=C(O)c1ccccc1- InChIKey
GNRGDZRKYVYAJF-UHFFFAOYSA-N- Molecular formula
- C19H28O9
- Average molar mass
- 400.4 g/mol
- Monoisotopic mass
- 400.17333247
Names & identifiers
- Preferred name
- Benzoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;prop-2-enoic acid
- IUPAC
- benzoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;bis(prop-2-enoic acid)
- English name
- Trimethylolpropane benzoate diacrylate
- Molecular formula
- C19H22O6
- Molecular weight
- 346.37
Names & synonyms
benzoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;prop-2-enoic acidPUBCHEM_53472002SCHEMBL4622841DTXSID70703819GNRGDZRKYVYAJF-UHFFFAOYSA-NTriMethylpropyl benzoate diacrylateTrimethylolpropane benzoate diacrylate2-Propenoic acid,1,1'-[2-[(benzoyloxy)methyl]-2-ethyl-1,3-propanediyl] ester
Database identifiers
- CAS
79720-88-0- PubChem CID
- 53472002
- DTXSID
DTXSID70703819
Properties
Computed structural properties
- Topological polar surface area
- 173 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- Boiling point
- 464 · 464.0±35.0 °C(Predicted)
- Density
- 1.126 g/mL · 1.126 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.511(lit.)
- Flash point
- 230 °F · >230 °F
- RIDADR
- 3082 · UN 3082 9/PG 3
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- ridadr
- UN 3082 9/PG 3
Chemistry & industry
Applications
Usesamine functionalized derivative, suitable for coupling to carboxyl- or aldehyde-containing ligands, displays reduced hemolytic activity compared to parent cyclodextrin
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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