| CAS Number | 16897-97-5 |
| Catalog Number | AG001YFA(AGN-PC-0KLC07) |
| Chemical Name | Ethanone, 2-(2-bromophenyl)-1-phenyl- |
| IUPAC Name | 2-(2-bromophenyl)-1-phenylethanone |
| InChI | InChI=1S/C14H11BrO/c15-13-9-5-4-8-12(13)10-14(16)11-6-2-1-3-7-11/h1-9H,10H2 |
| InChI Key | KJKUTYSDSVMXDM-UHFFFAOYSA-N |
| MDL Number | MFCD00204351 |
| Molecular Formula | C14H11BrO |
| Molecular Weight | 275.1405 |
| SMILES | O=C(C1=CC=CC=C1)CC2=CC=CC=C2Br |
| Synonyms | 2-(2-BROMOPHENYL)ACETOPHENONE,
16897-97-5,
2-(2-bromophenyl)-1-phenylethanone,
2-(2-Bromophenyl)-1-Phenylethan-1-One,
Ethanone, 2-(2-bromophenyl)-1-phenyl-,
2'-Bromodeoxybenzoin,
AC1MCW2L,
AC1Q24GP,
SCHEMBL2936987,
CTK4D3166,
DTXSID90384326,
ZINC133582,
MFCD00204351,
AKOS010014103,
CS-0060491,
ZINC00133582,
CID2801777,
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| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.145g/mol |
| Monoisotopic Mass | 273.999g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number