| CAS Number | 49732-38-9 |
| Catalog Number | AG003LA4(AGN-PC-0782CS) |
| Chemical Name | 4-DIAZO-4-METHOXYDIPHENYLAMINE SULFATE |
| IUPAC Name | hydrogen sulfate;4-(4-methoxyanilino)benzenediazonium |
| InChI | InChI=1S/C13H12N3O.H2O4S/c1-17-13-8-6-11(7-9-13)15-10-2-4-12(16-14)5-3-10;1-5(2,3)4/h2-9,15H,1H3;(H2,1,2,3,4)/q+1;/p-1 |
| InChI Key | UXVMTJSLLAUFTO-UHFFFAOYSA-M |
| MDL Number | MFCD00080910 |
| Molecular Formula | C13H13N3O5S |
| Molecular Weight | 323.3244 |
| SMILES | OS([O-])(=O)=O.COC1=CC=C(NC2=CC=C(C=C2)[N+]#N)C=C1 |
| Synonyms | 4-Diazo-4'-methoxydiphenylamine Sulfate,
49732-38-9,
4-(4-Methoxyanilino)benzenediazonium sulfate,
Azoic Diazo Component 35,
CTK4J1618,
DTXSID20659892,
MFCD00080910,
D2290,
FT-0765746,
4-[N-(4-Methoxyphenyl)amino]benzenediazonium Sulfate,
4-(4-Methoxyanilino)benzene-1-diazonium hydrogen sulfate,
4-(4-Methoxyphenylamino)benzenediazonium hydrogensulfate,
4-DIAZO-4 inverted exclamation mark -METHOXYDIPHENYLAMINE SULFATE,
4-DIAZO-4'-METHOXYDIPHENYLAMINESULFATE,
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| Complexity | 346 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 323.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 323.323g/mol |
| Monoisotopic Mass | 323.058g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 135A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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