| CAS Number | 120445-83-2 |
| Catalog Number | AG00HFGY(AGN-PC-0O04VZ) |
| Chemical Name | 2'-Chloroacetophenone semicarbazone |
| IUPAC Name | [1-(2-chlorophenyl)ethylideneamino]urea |
| InChI | InChI=1S/C9H10ClN3O/c1-6(12-13-9(11)14)7-4-2-3-5-8(7)10/h2-5H,1H3,(H3,11,13,14) |
| InChI Key | QRYYNWCEQGXCED-UHFFFAOYSA-N |
| MDL Number | MFCD04109762 |
| Molecular Formula | C9H10ClN3O |
| Molecular Weight | 211.6482 |
| SMILES | NC(=O)N/N=C(/c1ccccc1Cl)C |
| Synonyms | 121149-68-6,
Hydrazinecarboxamide, 2-[1-(2-chlorophenyl)ethylidene]-,
120445-83-2,
2-(1-(2-Chlorophenyl)ethylidene)hydrazinecarboxamide,
ACMC-20mpbs,
[1-(2-chlorophenyl)ethylideneamino]urea,
AC1L6LVO,
CTK0F8498,
DTXSID50296532,
AKOS017263263,
MCULE-6112179998,
Hydrazinecarboxamide, 2-[1-(2-chlorophenyl)ethylidene]-, (E)-,
CID269177,
NSC109774,
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| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.649g/mol |
| Monoisotopic Mass | 211.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number