| CAS Number | 56966-61-1 |
| Catalog Number | AG00ELWU(AGN-PC-00TTMU) |
| Chemical Name | 4-Bromo-2-nitro-1-phenoxybenzene |
| IUPAC Name | 4-bromo-2-nitro-1-phenoxybenzene |
| InChI | InChI=1S/C12H8BrNO3/c13-9-6-7-12(11(8-9)14(15)16)17-10-4-2-1-3-5-10/h1-8H |
| InChI Key | CPEIRSYGYOEBET-UHFFFAOYSA-N |
| MDL Number | MFCD13191935 |
| Molecular Formula | C12H8BrNO3 |
| Molecular Weight | 294.1008 |
| SMILES | [O-][N+](C1=C(OC2=CC=CC=C2)C=CC(Br)=C1)=O |
| Synonyms | 4-Bromo-2-nitro-1-phenoxybenzene,
56966-61-1,
SCHEMBL1128860,
CTK8C2536,
DTXSID50582982,
CPEIRSYGYOEBET-UHFFFAOYSA-N,
8351AB,
ANW-68555,
MFCD13191935,
ZINC35259185,
AKOS010631457,
Benzene, 4-bromo-2-nitro-1-phenoxy-,
NE20658,
AJ-90838,
TC-157300,
C12H8BrNO3,
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| Complexity | 263 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.969g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.104g/mol |
| Monoisotopic Mass | 292.969g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number