| CAS Number | 41052-26-0 |
| Catalog Number | AG0073D4(AGN-PC-009J7T) |
| Chemical Name | 2-Bromo-5-nitrobenzamide |
| IUPAC Name | 2-bromo-5-nitrobenzamide |
| InChI | InChI=1S/C7H5BrN2O3/c8-6-2-1-4(10(12)13)3-5(6)7(9)11/h1-3H,(H2,9,11) |
| InChI Key | KQSFFJRDGVAPPI-UHFFFAOYSA-N |
| MDL Number | MFCD01320498 |
| Molecular Formula | C7H5BrN2O3 |
| Molecular Weight | 245.0302 |
| SMILES | NC(=O)C1=CC(=CC=C1Br)[N+]([O-])=O |
| Synonyms | 2-bromo-5-nitrobenzamide,
2-bromo-5-nitro-benzamide,
41052-26-0,
Benzamide, 2-bromo-5-nitro-,
SCHEMBL4638377,
CTK1C9159,
DTXSID10466577,
CS-D1281,
ZINC2379198,
MFCD01320498,
STK498001,
AKOS000283213,
FCH4631950,
MCULE-9850153702,
AJ-34557,
AK142945,
AS-42104,
BBV-33654864,
AX8037005,
CID11459217,
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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 | 243.948g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.032g/mol |
| Monoisotopic Mass | 243.948g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 88.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number