Basic information
- CAS
93653-37-3- Standard SMILES
COC(=O)C(C(=O)OC)C(c1ccccc1)C(Br)(C(=O)OC)C(=O)OC- InChIKey
UJPXBVHKLSUSDE-UHFFFAOYSA-N- Molecular formula
- C17H19BrO8
- Average molar mass
- 431.2 g/mol
- Monoisotopic mass
- 430.02633
Names & identifiers
- Preferred name
- Tetramethyl 1-bromo-2-phenylpropane-1,1,3,3-tetracarboxylate
- IUPAC
- tetramethyl 1-bromo-2-phenylpropane-1,1,3,3-tetracarboxylate
Names & synonyms
93653-37-3tetramethyl 1-bromo-2-phenylpropane-1,1,3,3-tetracarboxylateNSC227198DTXSID20310436NSC-227198
Database identifiers
- CAS
93653-37-3- PubChem CID
- 313328
- DTXSID
DTXSID20310436
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 509
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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