| CAS Number | 1390327-96-4 |
| Catalog Number | AG00HVCH(AGN-PC-0WRA4H) |
| Chemical Name | 1,3-Dibromo-2-(2-methoxyethoxy)benzene |
| IUPAC Name | 1,3-dibromo-2-(2-methoxyethoxy)benzene |
| InChI | InChI=1S/C9H10Br2O2/c1-12-5-6-13-9-7(10)3-2-4-8(9)11/h2-4H,5-6H2,1H3 |
| InChI Key | OZWNDWAQVVJBOC-UHFFFAOYSA-N |
| MDL Number | MFCD30182402 |
| Molecular Formula | C9H10Br2O2 |
| Molecular Weight | 309.9825 |
| SMILES | COCCOc1c(Br)cccc1Br |
| Synonyms | 1,3-dibromo-2-(2-methoxyethoxy)benzene,
1390327-96-4,
AKOS008861833,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 309.903g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 309.985g/mol |
| Monoisotopic Mass | 307.905g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
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