| CAS Number | 1227160-18-0 |
| Catalog Number | AG009DTX(AGN-PC-08XZJV) |
| Chemical Name | 1-Bromo-4-(1-trifluoromethyl-cyclopropyl)-benzene |
| IUPAC Name | 1-bromo-4-[1-(trifluoromethyl)cyclopropyl]benzene |
| InChI | InChI=1S/C10H8BrF3/c11-8-3-1-7(2-4-8)9(5-6-9)10(12,13)14/h1-4H,5-6H2 |
| InChI Key | LJOJKFHNKMTEFS-UHFFFAOYSA-N |
| MDL Number | MFCD16817615 |
| Molecular Formula | C10H8BrF3 |
| Molecular Weight | 265.0697 |
| SMILES | FC(C1(C2=CC=C(Br)C=C2)CC1)(F)F |
| Synonyms | 1227160-18-0,
1-BROMO-4-(1-(TRIFLUOROMETHYL)CYCLOPROPYL)BENZENE,
1-bromo-4-[1-(trifluoromethyl)cyclopropyl]benzene,
1-Bromo-4-(1-trifluoromethyl-cyclopropyl)-benzene,
1-Bromo-4-(1-trifluoromethylcyclopropyl)benzene,
SCHEMBL516639,
DTXSID30679304,
LJOJKFHNKMTEFS-UHFFFAOYSA-N,
BBL102152,
MFCD16817615,
STL555951,
ZINC67794373,
AKOS017344127,
AS-42210,
AB0082058,
1-(4-Bromophenyl)-1-(trifluoromethyl)cyclopropane,
1-bromo-4-(1-trifluoromethyl-cyclopropyl)benzene,
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| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.073g/mol |
| Monoisotopic Mass | 263.976g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^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
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