| CAS Number | 21766-81-4 |
| Catalog Number | AG00BJO1(AGN-PC-0NK460) |
| Chemical Name | Ethanone, 1-[2,5-bis(phenylmethoxy)phenyl]- |
| IUPAC Name | 1-[2,5-bis(phenylmethoxy)phenyl]ethanone |
| InChI | InChI=1S/C22H20O3/c1-17(23)21-14-20(24-15-18-8-4-2-5-9-18)12-13-22(21)25-16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3 |
| InChI Key | UQJUOEWQZNRLJJ-UHFFFAOYSA-N |
| MDL Number | MFCD30573979 |
| Molecular Formula | C22H20O3 |
| Molecular Weight | 332.3924 |
| SMILES | CC(C1=CC(OCC2=CC=CC=C2)=CC=C1OCC3=CC=CC=C3)=O |
| Synonyms | 1-(2,5-Bis(benzyloxy)phenyl)ethanone,
21766-81-4,
1-[2,5-Bis(benzyloxy)phenyl]ethanone,
SCHEMBL2785214,
UQJUOEWQZNRLJJ-UHFFFAOYSA-N,
AKOS030573718,
1-(2,5-Bis(benzyloxy)phenyl)ethan-1-one,
CS-0059740,
Ethanone, 1-[2,5-bis(phenylmethoxy)phenyl]-,
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| Complexity | 396 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 332.141g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 332.399g/mol |
| Monoisotopic Mass | 332.141g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number