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1-Phenyl-2-nitropropene

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  • What is 1-Phenyl-2-nitropropene?
  • 1-phenyl-2-nitropropene is used in the production of pharmaceuticals, for instance, for drug Adderall, a drug used to treat AD....
  • Aug 26，2021
1-Phenyl-2-nitropropene Basic information
Product Name:1-Phenyl-2-nitropropene
Synonyms:1-(PHENYL) 2-NITROPROPENE;2-NITROPROP-1-ENYLBENZENE;2-NITRO-1-PHENYLPROPENE;BETA-METHYLNITROSTYRENE;BETA-METHYL-BETA-NITROSTYRENE;TIMTEC-BB SBB003925;trans-β-methyl-β-nitrostyrene;NITROPROPENYLBENZENE
CAS:705-60-2
MF:C9H9NO2
MW:163.17
EINECS:627-363-3
Product Categories:Building Blocks;Chemical Synthesis;Organic Building Blocks;Aromatics;Intermediates & Fine Chemicals;Pharmaceuticals;Aromatic Hydrocarbons (substituted) & Derivatives;Acyclic;Alkenes;Organic Building Blocks;705-60-2
Mol File:705-60-2.mol
1-Phenyl-2-nitropropene Structure
1-Phenyl-2-nitropropene Chemical Properties
Melting point 63-65 °C (lit.)
Boiling point 263.0±9.0 °C(Predicted)
density 1.141±0.06 g/cm3(Predicted)
storage temp. 2-8°C
solubility Acetone, Chloroform, Dichloromethane, Methanol
form Crystalline Powder
color Yellow
InChIInChI=1S/C9H9NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-7H,1H3
InChIKeyWGSVFWFSJDAYBM-BQYQJAHWSA-N
SMILESC1(C=C([N+]([O-])=O)C)=CC=CC=C1
NIST Chemistry ReferenceBenzene, (2-nitro-1-propenyl)-(705-60-2)
EPA Substance Registry System(2-Nitro-1-propenyl)benzene (705-60-2)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36-37/39
WGK Germany 3
RTECS DA6495000
HS Code 29042090
MSDS Information
ProviderLanguage
SigmaAldrich English
ALFA English
1-Phenyl-2-nitropropene Usage And Synthesis
Chemical PropertiesYellow crystalline powder
Uses1-phenyl-2-nitropropene is used in the production of pharmaceuticals, for instance, for drug Adderall, a drug used to treat ADHD and narcolepsy.
Application(2-Nitropropenyl)benzene is a derivative of styrene (S687790), which exhibits herbicidal and antibacterial properties.
Synthesis Reference(s)The Journal of Organic Chemistry, 15, p. 8, 1950 DOI: 10.1021/jo01147a002
Tetrahedron Letters, 26, p. 1193, 1985 DOI: 10.1016/S0040-4039(00)98431-4
General Descriptiontrans-β-Methyl-β-nitrostyrene (1-phenyl-2-nitropropene), a nitrostyrene derivative is an α,β-disubstituted nitroalkene. It has been synthesized by reacting benzaldehyde with nitroethane and butylamine. Spectroscopic analysis of 1-phenyl-2-nitropropene has been done using FT-IR, FT-Raman, NMR and UV.
1-Phenyl-2-nitropropene Preparation Products And Raw materials
Preparation Products4-Methyl-2,5-diphenylimidazole-->Hydroxylamine, N-(alpha-methylphenethyl)-, hydrochloride, (+-)-
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