| CAS Number | 1881322-02-6 |
| Catalog Number | AG00I2F5(AGN-PC-0WR7N6) |
| Chemical Name | 1-chloro-3-(2-methoxyethoxy)-5-nitrobenzene |
| IUPAC Name | 1-chloro-3-(2-methoxyethoxy)-5-nitrobenzene |
| InChI | InChI=1S/C9H10ClNO4/c1-14-2-3-15-9-5-7(10)4-8(6-9)11(12)13/h4-6H,2-3H2,1H3 |
| InChI Key | KMMCEXIQCXJSAO-UHFFFAOYSA-N |
| MDL Number | MFCD29043482 |
| Molecular Formula | C9H10ClNO4 |
| Molecular Weight | 231.6330 |
| SMILES | COCCOc1cc(Cl)cc(c1)[N+](=O)[O-] |
| Synonyms | 1-CHLORO-3-(2-METHOXYETHOXY)-5-NITROBENZENE,
1881322-02-6,
ZINC261493844,
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| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.632g/mol |
| Monoisotopic Mass | 231.03g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 64.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number