| CAS Number | 31481-85-3 |
| Catalog Number | AG00I5YI(AGN-PC-0WB2JQ) |
| Chemical Name | 4-(2-Acetylhydrazino)-3-nitropyridine |
| IUPAC Name | N'-(3-nitropyridin-4-yl)acetohydrazide |
| InChI | InChI=1S/C7H8N4O3/c1-5(12)9-10-6-2-3-8-4-7(6)11(13)14/h2-4H,1H3,(H,8,10)(H,9,12) |
| InChI Key | MZXDFFGWNNDJEP-UHFFFAOYSA-N |
| MDL Number | MFCD00956008 |
| Molecular Formula | C7H8N4O3 |
| Molecular Weight | 196.1634 |
| SMILES | O=[N+]([O-])C1(=C(NNC(=O)C)C=CN=C1) |
| Synonyms | 4-(2-Acetylhydrazino)-3-nitropyridine,
N'-(3-nitropyridin-4-yl)acetohydrazide,
31481-85-3,
CTK6A1231,
KS-00002AMU,
ZINC5283506,
ZX-AT004640,
OR9519,
AKOS026675539,
FCH1122366,
PS-6221,
K-7435,
AC1MY66X,
CID3851780,
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| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.05964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.16g/mol |
| Monoisotopic Mass | 196.05964g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 99.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number