| CAS Number | 860594-34-9 |
| Catalog Number | AG004UBN(AGN-PC-0WCDET) |
| Chemical Name | 2-Bromo-4'-ethoxybenzophenone |
| IUPAC Name | (2-bromophenyl)-(4-ethoxyphenyl)methanone |
| InChI | InChI=1S/C15H13BrO2/c1-2-18-12-9-7-11(8-10-12)15(17)13-5-3-4-6-14(13)16/h3-10H,2H2,1H3 |
| InChI Key | XBCVWESUGMFWMM-UHFFFAOYSA-N |
| MDL Number | MFCD09801558 |
| Molecular Formula | C15H13BrO2 |
| Molecular Weight | 305.1665 |
| SMILES | C(=O)(C1=CC=C(OCC)C=C1)C1=CC=CC=C1Br |
| Synonyms | 2-BROMO-4'-ETHOXYBENZOPHENONE,
860594-34-9,
CTK5F6224,
DTXSID20641757,
MFCD09801558,
ZINC37358375,
AKOS009338354,
(2-Bromophenyl)(4-ethoxyphenyl)methanone,
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| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 304.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 305.171g/mol |
| Monoisotopic Mass | 304.01g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number