| CAS Number | 26820-54-2 |
| Catalog Number | AG00BH7Y(AGN-PC-0JTFV0) |
| Chemical Name | 2-N-Butylamino-5-nitropyridine |
| IUPAC Name | N-butyl-5-nitropyridin-2-amine |
| InChI | InChI=1S/C9H13N3O2/c1-2-3-6-10-9-5-4-8(7-11-9)12(13)14/h4-5,7H,2-3,6H2,1H3,(H,10,11) |
| InChI Key | AFJQLCOKPDRRAN-UHFFFAOYSA-N |
| MDL Number | MFCD11116745 |
| Molecular Formula | C9H13N3O2 |
| Molecular Weight | 195.2184 |
| SMILES | CCCCNc1ccc(cn1)[N+](=O)[O-] |
| Synonyms | 2-N-Butylamino-5-nitropyridine,
26820-54-2,
2-Butylamino-5-nitropyridine,
N-(5-Nitro-2-pyridyl)butylamine,
2-Pyridinamine, N-butyl-5-nitro-,
AC1LC0UG,
N-butyl-5-nitropyridin-2-amine,
CTK0I5924,
DTXSID60343804,
AFJQLCOKPDRRAN-UHFFFAOYSA-N,
n-Butyl-5-nitro-2-pyridinamine #,
ZINC20016209,
AKOS008995110,
ACM26820542,
BBV-46879778,
V4807,
C9H13N3O2,
CID592373,
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| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.222g/mol |
| Monoisotopic Mass | 195.101g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 70.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number