| CAS Number | 1248045-93-3 |
| Catalog Number | AG00HHSQ(AGN-PC-0WOCWB) |
| Chemical Name | 5-Bromo-7-chloro-1,3-benzoxazol-2-amine |
| IUPAC Name | 5-bromo-7-chloro-1,3-benzoxazol-2-amine |
| InChI | InChI=1S/C7H4BrClN2O/c8-3-1-4(9)6-5(2-3)11-7(10)12-6/h1-2H,(H2,10,11) |
| InChI Key | WKSJMJXQUPOKLW-UHFFFAOYSA-N |
| MDL Number | MFCD16742781 |
| Molecular Formula | C7H4BrClN2O |
| Molecular Weight | 247.4765 |
| SMILES | NC1OC2=C(C=C(C=C2Cl)Br)N=1 |
| Synonyms | 5-bromo-7-chloro-1,3-benzoxazol-2-amine,
1248045-93-3,
5-Bromo-7-chlorobenzo[d]oxazol-2-amine,
SCHEMBL19922859,
ZINC52066071,
AKOS011654781,
Z2301499856,
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| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.92g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.476g/mol |
| Monoisotopic Mass | 245.92g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number