| CAS Number | 128924-04-9 |
| Catalog Number | AG009JO9(AGN-PC-0NGLBA) |
| Chemical Name | 1,3-Bis(benzyloxy)-5-bromobenzene |
| IUPAC Name | 1-bromo-3,5-bis(phenylmethoxy)benzene |
| InChI | InChI=1S/C20H17BrO2/c21-18-11-19(22-14-16-7-3-1-4-8-16)13-20(12-18)23-15-17-9-5-2-6-10-17/h1-13H,14-15H2 |
| InChI Key | ZVDWFQPJADEFJA-UHFFFAOYSA-N |
| MDL Number | MFCD26131152 |
| Molecular Formula | C20H17BrO2 |
| Molecular Weight | 369.2518 |
| SMILES | Brc1cc(OCc2ccccc2)cc(c1)OCc1ccccc1 |
| Synonyms | 1,3-BIS(BENZYLOXY)-5-BROMOBENZENE,
128924-04-9,
SCHEMBL10046165,
1,3-dibenzyloxy-5-bromo-benzene,
ZVDWFQPJADEFJA-UHFFFAOYSA-N,
1,3-Bis-benzyloxy-5-bromobenzene,
1,3-bis-benzyloxy-5-bromo-benzene,
1-Bromo-3,5-bis(benzyloxy)benzene,
ZINC38298704,
AKOS024438469,
Z9450,
K-4013,
C20H17BrO2,
1-bromo-3,5-bis(phenylmethoxy)benzene,
CID11143141,
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| Complexity | 294 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 368.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 369.258g/mol |
| Monoisotopic Mass | 368.041g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number