Basic information
- CAS
618390-58-2- Standard SMILES
O=c1c(-c2ccc(OCc3ccccc3Cl)cc2)coc2cc(OCc3ccccc3Cl)cc(OCc3ccccc3Cl)c12- InChIKey
YICAYVLOMJIPGM-UHFFFAOYSA-N- Molecular formula
- C36H25Cl3O5
- Average molar mass
- 643.9 g/mol
Names & identifiers
- Preferred name
- 5,7-bis[(2-chlorobenzyl)oxy]-3-{4-[(2-chlorobenzyl)oxy]phenyl}-4H-chromen-4-one
- IUPAC
- 5,7-bis[(2-chlorophenyl)methoxy]-3-[4-[(2-chlorophenyl)methoxy]phenyl]chromen-4-one
- English name
- 5,7-bis[(2-chlorobenzyl)oxy]-3-{4-[(2-chlorobenzyl)oxy]phenyl}-4H-chromen-4-one
- Molecular formula
- C36H25Cl3O5
- Molecular weight
- 643.9397
Names & synonyms
5,7-bis[(2-chlorobenzyl)oxy]-3-{4-[(2-chlorobenzyl)oxy]phenyl}-4H-chromen-4-oneSTK888845AKOS0021809445,7-bis[(2-chlorophenyl)methoxy]-3-[4-[(2-chlorophenyl)methoxy]phenyl]chromen-4-oneST50071216AF-399/418837965,7-bis[(2-chlorophenyl)methoxy]-3-{4-[(2-chlorophenyl)methoxy]phenyl}chromen- 4-one
Database identifiers
- CAS
618390-58-2
Properties
Computed structural properties
- XLogP
- 9.5
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 954
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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