| CAS Number | 1803590-09-1 |
| Catalog Number | AG01B90C |
| Chemical Name | 2-CHLORO-3-NITROANILINE HYDROCHLORIDE |
| IUPAC Name | 2-chloro-3-nitroaniline;hydrochloride |
| InChI | InChI=1S/C6H5ClN2O2.ClH/c7-6-4(8)2-1-3-5(6)9(10)11;/h1-3H,8H2;1H |
| InChI Key | XQVYCAHHMDGVJV-UHFFFAOYSA-N |
| MDL Number | MFCD28348198 |
| Molecular Formula | C6H6Cl2N2O2 |
| Molecular Weight | 209.0300 |
| SMILES | NC1=CC=CC([N+]([O-])=O)=C1Cl.[H]Cl |
| Synonyms | 2-chloro-3-nitroaniline hydrochloride,
1803590-09-1,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.981g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.026g/mol |
| Monoisotopic Mass | 207.981g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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