Determine the necessary mass, volume, or concentration for preparing a solution.
Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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SKU | Size | Availability | Price | Qty |
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R405571-1g | 1g | 5 | $137.90 | |
R405571-5g | 5g | 2 | $549.90 |
Synonyms | T71243 | STK011701 | R-(-)-N-(3,5-Dinitrobenzoyl)-1-phenylethylamine | AKOS015888875 | SCHEMBL3057546 | ABEVDCGKLRIYRW-SNVBAGLBSA-N | AKOS015833349 | 3,5-dinitro-N-[(1R)-1-phenylethyl]benzamide | (R)-(-)-N-(3,5-Dinitrobenzoyl)-.alpha.-methylbenzylamine | |
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Specifications & Purity | ≥98% |
Product Description | (R)-(−)-3,5-Dinitro-N-(1-phenylethyl)benzamide is a chiral derivatizating agent, which is employed for derivatizing enantiomers into diastereoisomers. It is an organic compound, which can effectively inhibit the replications of the Hepatitis C virus (HCV) and other viral infections. Application: (R)-(−)-3,5-Dinitro-N-(1-phenylethyl)benzamide may be used as a standard for determining its standard molar enthalpy of combustion and formation using an isoperibolic micro-combustion calorimeter. |
Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Pubchem Sid | 488193980 |
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Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488193980 |
IUPAC Name | 3,5-dinitro-N-[(1R)-1-phenylethyl]benzamide |
INCHI | InChI=1S/C15H13N3O5/c1-10(11-5-3-2-4-6-11)16-15(19)12-7-13(17(20)21)9-14(8-12)18(22)23/h2-10H,1H3,(H,16,19)/t10-/m1/s1 |
InChi Key | ABEVDCGKLRIYRW-SNVBAGLBSA-N |
Canonical SMILES | CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Isomeric SMILES | C[C@H](C1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
PubChem CID | 2794133 |
Molecular Weight | 315.29 |
Reaxy-Rn | 3627249 |
Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3627249&ln= |
Specific Rotation[α] | [α]18/D −46°, c = 0.9 in acetone |
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Melt Point(°C) | 159 °C |
Molecular Weight | 315.280 g/mol |
XLogP3 | 2.800 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
Exact Mass | 315.086 Da |
Monoisotopic Mass | 315.086 Da |
Topological Polar Surface Area | 121.000 Ų |
Heavy Atom Count | 23 |
Formal Charge | 0 |
Complexity | 431.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 1 |
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 |
Pictogram(s) | GHS07 |
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Signal | Warning |
Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation |
Precautionary Statements | P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell. |
Reaxy-Rn | 3627249 |
Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3627249&ln= |