Determine the necessary mass, volume, or concentration for preparing a solution.
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SKU | Size | Availability | Price | Qty |
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B183959-1g | 1g | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $207.90 | |
B183959-5g | 5g | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $626.90 |
Synonyms | 3-Bromo-N,N-diisopropylbenzamide | 35309-72-9 | 3-bromo-N,N-di(propan-2-yl)benzamide | 3-bromo-N,N-bis(propan-2-yl)benzamide | DTXSID70399877 | MFCD00587757 | AKOS002970813 | AM87834 | AS-8176 | CS-0451558 | N10346 | A874641 |
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Specifications & Purity | ≥98% |
Storage Temp | Room temperature |
Shipped In | Normal |
IUPAC Name | 3-bromo-N,N-di(propan-2-yl)benzamide |
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INCHI | InChI=1S/C13H18BrNO/c1-9(2)15(10(3)4)13(16)11-6-5-7-12(14)8-11/h5-10H,1-4H3 |
InChi Key | DBWZQUIZKNKCRM-UHFFFAOYSA-N |
Canonical SMILES | CC(C)N(C(C)C)C(=O)C1=CC(=CC=C1)Br |
Isomeric SMILES | CC(C)N(C(C)C)C(=O)C1=CC(=CC=C1)Br |
Molecular Weight | 284.2 |
Reaxy-Rn | 2452009 |
Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2452009&ln= |
Molecular Weight | 284.190 g/mol |
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XLogP3 | 4.400 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 3 |
Exact Mass | 283.057 Da |
Monoisotopic Mass | 283.057 Da |
Topological Polar Surface Area | 20.300 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 232.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
The total count of all stereochemical bonds | 0 |
Covalently-Bonded Unit Count | 1 |
Reaxy-Rn | 2452009 |
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Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2452009&ln= |