| CAS Number | 1194769-56-6 |
| Catalog Number | AG00HF0R(AGN-PC-0WQVN3) |
| Chemical Name | 5-Bromo-2-methylbenzohydrazide |
| IUPAC Name | 5-bromo-2-methylbenzohydrazide |
| InChI | InChI=1S/C8H9BrN2O/c1-5-2-3-6(9)4-7(5)8(12)11-10/h2-4H,10H2,1H3,(H,11,12) |
| InChI Key | CYNQOZLWZZBUCY-UHFFFAOYSA-N |
| MDL Number | MFCD21192995 |
| Molecular Formula | C8H9BrN2O |
| Molecular Weight | 229.0739 |
| SMILES | CC1=C(C(NN)=O)C=C(Br)C=C1 |
| Synonyms | 5-Bromo-2-methylbenzohydrazide,
1194769-56-6,
SCHEMBL12909242,
MFCD21192995,
ZINC83688816,
AKOS014642947,
Benzoic acid, 5-bromo-2-methyl-, hydrazide,
CS-0038934,
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| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.077g/mol |
| Monoisotopic Mass | 227.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number