| CAS Number | 1393441-77-4 |
| Catalog Number | AG009X2U(AGN-PC-0WAA3Z) |
| Chemical Name | 4-Bromo-5-chloro-2-(2-methoxyethoxy)aniline |
| IUPAC Name | 4-bromo-5-chloro-2-(2-methoxyethoxy)aniline |
| InChI | InChI=1S/C9H11BrClNO2/c1-13-2-3-14-9-4-6(10)7(11)5-8(9)12/h4-5H,2-3,12H2,1H3 |
| InChI Key | QZKLYPSJSIMELL-UHFFFAOYSA-N |
| MDL Number | MFCD22383660 |
| Molecular Formula | C9H11BrClNO2 |
| Molecular Weight | 280.5461 |
| SMILES | COCCOc1cc(Br)c(cc1N)Cl |
| Synonyms | 4-Bromo-5-chloro-2-(2-methoxyethoxy)aniline,
1393441-77-4,
ZINC95494778,
V2907,
C9H11BrClNO2,
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| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.966g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.546g/mol |
| Monoisotopic Mass | 278.966g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number