(4-Bromophenyl)methyl 2-(4-bromophenyl)-2-oxoethyl heptanedioate
Basic information
- CAS
7622-01-7- Standard SMILES
O=C(CCCCCC(=O)OCc1ccc(Br)cc1)OCC(=O)c1ccc(Br)cc1- InChIKey
CFNTURHEGQFFBH-UHFFFAOYSA-N- Molecular formula
- C22H22Br2O5
- Average molar mass
- 526.2 g/mol
- Monoisotopic mass
- 523.9834
Names & identifiers
- Preferred name
- (4-Bromophenyl)methyl 2-(4-bromophenyl)-2-oxoethyl heptanedioate
- IUPAC
- 1-O-[(4-bromophenyl)methyl] 7-O-[2-(4-bromophenyl)-2-oxoethyl] heptanedioate
Names & synonyms
7622-01-7NSC405699DTXSID20324093(4-Bromophenyl)methyl 2-(4-bromophenyl)-2-oxoethyl heptanedioateNSC-405699
Database identifiers
- CAS
7622-01-7- PubChem CID
- 347185
- DTXSID
DTXSID20324093
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 523
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…