| CAS Number | 1096354-40-3 |
| Catalog Number | AG007SUE(AGN-PC-06IIPR) |
| Chemical Name | 3-Bromo-2-ethoxy-5-fluoroaniline |
| IUPAC Name | 3-bromo-2-ethoxy-5-fluoroaniline |
| InChI | InChI=1S/C8H9BrFNO/c1-2-12-8-6(9)3-5(10)4-7(8)11/h3-4H,2,11H2,1H3 |
| InChI Key | RLUDPHPSOKVCEP-UHFFFAOYSA-N |
| MDL Number | MFCD13623652 |
| Molecular Formula | C8H9BrFNO |
| Molecular Weight | 234.0656 |
| SMILES | CCOC1=C(Br)C=C(F)C=C1N |
| Synonyms | 3-Bromo-2-ethoxy-5-fluoroaniline,
1096354-40-3,
ACMC-20993w,
CTK8A9213,
DTXSID10655727,
ANW-16074,
ZINC37250564,
AKOS009113718,
CJ-19025,
TC-104819,
Z7283,
C8H9BrFNO,
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| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.068g/mol |
| Monoisotopic Mass | 232.985g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number