| CAS Number | 1352317-77-1 |
| Catalog Number | AG007ZOF(AGN-PC-0WNQNU) |
| Chemical Name | 2-Bromo-1-butoxy-4-nitrobenzene |
| IUPAC Name | 2-bromo-1-butoxy-4-nitrobenzene |
| InChI | InChI=1S/C10H12BrNO3/c1-2-3-6-15-10-5-4-8(12(13)14)7-9(10)11/h4-5,7H,2-3,6H2,1H3 |
| InChI Key | GKSVZLWXYJLMNN-UHFFFAOYSA-N |
| MDL Number | MFCD20529435 |
| Molecular Formula | C10H12BrNO3 |
| Molecular Weight | 274.1112 |
| SMILES | CCCCOc1ccc(cc1Br)[N+](=O)[O-] |
| Synonyms | 2-Bromo-1-butoxy-4-nitrobenzene,
1352317-77-1,
ACMC-209by8,
SCHEMBL13140933,
CTK8B0278,
DTXSID20718317,
ANW-19758,
MFCD20529435,
ZINC74937711,
AJ-121413,
TC-108503,
Z9846,
B-8426,
C10H12BrNO3,
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| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.114g/mol |
| Monoisotopic Mass | 273g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number