| CAS Number | 771581-97-6 |
| Catalog Number | AG00ICSY(AGN-PC-0WP1OG) |
| Chemical Name | (2,6-Dichloro-5-fluoropyridin-3-yl)methanamine |
| IUPAC Name | (2,6-dichloro-5-fluoropyridin-3-yl)methanamine |
| InChI | InChI=1S/C6H5Cl2FN2/c7-5-3(2-10)1-4(9)6(8)11-5/h1H,2,10H2 |
| InChI Key | LNLBGKHMSCZAJX-UHFFFAOYSA-N |
| MDL Number | MFCD06213012 |
| Molecular Formula | C6H5Cl2FN2 |
| Molecular Weight | 195.0217 |
| SMILES | NCC1=C(Cl)N=C(Cl)C(F)=C1 |
| Synonyms | (2,6-dichloro-5-fluoropyridin-3-yl)methanamine,
771581-97-6,
SCHEMBL4882024,
LNLBGKHMSCZAJX-UHFFFAOYSA-N,
ZINC44248971,
AKOS006292268,
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| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.981g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.018g/mol |
| Monoisotopic Mass | 193.981g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
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