| CAS Number | 3352-98-5 |
| Catalog Number | AG00I6LM(AGN-PC-0JOD1P) |
| Chemical Name | 4'-Methylacetophenone semicarbazone |
| IUPAC Name | [1-(4-methylphenyl)ethylideneamino]urea |
| InChI | InChI=1S/C10H13N3O/c1-7-3-5-9(6-4-7)8(2)12-13-10(11)14/h3-6H,1-2H3,(H3,11,13,14) |
| InChI Key | UORDOKZAZGHLGC-UHFFFAOYSA-N |
| MDL Number | MFCD00094281 |
| Molecular Formula | C10H13N3O |
| Molecular Weight | 191.2297 |
| SMILES | CC1=CC=C(C=C1)C(=NNC(=O)N)C |
| Synonyms | 120445-91-2,
2-[(E)-1-(4-methylphenyl)ethylidene]-1-hydrazinecarboxamide,
3352-98-5,
2-((E)-1-(4-Methylphenyl)ethylidene)-1-hydrazinecarboxamide,
4'-METHYLACETOPHENONE SEMICARBAZONE,
2-(1-(p-Tolyl)ethylidene)hydrazinecarboxamide,
[1-(4-methylphenyl)ethylideneamino]urea,
[(E)-[1-(4-methylphenyl)ethylidene]amino]urea,
AC1L5XJC,
CTK4H0766,
KS-00001S4R,
AKOS017263229,
ZINC252448258,
MCULE-5216797470,
(E)-2-(1-p-tolylethylidene)hydrazinecarboxamide,
NSC39871,
CID236857,
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| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.234g/mol |
| Monoisotopic Mass | 191.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number