Home Nitro Compounds 5345-42-6
5345-42-6,MFCD00007179
Catalog No.:AA003JMG

5345-42-6 | 3-Methyl-2-nitroanisole

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1g
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5g
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10g
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25g
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500g
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003JMG
Chemical Name:
3-Methyl-2-nitroanisole
CAS Number:
5345-42-6
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD00007179
SMILES:
COc1cccc(c1[N+](=O)[O-])C
NSC Number:
3040
Properties
Properties
 
BP:
271.1°C at 760 mmHg  
Form:
Solid  
MP:
48-50 °C  
Refractive Index:
1.5570 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
166  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
2.1  

Upstream Synthesis Route

[1]NewJournalofChemistry,2006,vol.30,#2,p.168-176

[2]BioorganicandMedicinalChemistry,2008,vol.16,#6,p.3309-3320

[3]Organicletters,2000,vol.2,#3,p.277-280

[4]Patent:WO2006/15985,2006,A1,.Locationinpatent:Page/Pagecolumn54-55

[5]JournaloftheChemicalSociety,1926,p.1425

[6]JournaloftheChemicalSociety,1923,vol.123,p.2989

[7]JournaloftheChemicalSociety,1924,vol.125,p.1305

[8]JournaloftheChemicalSociety,1923,vol.123,p.1272

[9]JournaloftheChemicalSociety,1936,p.319,321

[10]JournaloftheAmericanChemicalSociety,1941,vol.63,p.535

[11]JournalofOrganicChemistry,1961,vol.26,p.2310-2316

[12]JournalofOrganicChemistry,1967,vol.32,p.1479-1483

[13]AnalyticalChemistry,1992,vol.64,#8,p.837-842

[14]OrganicLetters,2010,vol.12,#8,p.1732-1735

[1]JournaloftheChemicalSociety,1926,p.1425

[1]BiochemicalPreparations,1958,vol.6,p.20,21

[1]ChemistryofNaturalCompounds,1986,vol.22,#4,p.435-438

[2]KhimiyaPrirodnykhSoedinenii,1986,vol.22,#4,p.465-469

[3]BiochemicalPreparations,1958,vol.6,p.20,21

[4]AustralianJournalofChemistry,1976,vol.29,p.2003-2021

[5]LettersinDrugDesignandDiscovery,2013,vol.10,#4,p.369-373

[1]AnalyticalChemistry,1992,vol.64,#8,p.837-842

[2]JournaloftheChemicalSociety,1936,p.319,321

[3]JournalofOrganicChemistry,1961,vol.26,p.2310-2316

Downstream Synthesis Route

[1]OrganicLetters,2018,vol.20,p.5058-5061

[2]Lettersindrugdesignanddiscovery,2013,vol.10,p.369-373

[3]BiochemicalPreparations,1958,vol.6,p.20,21

[4]JournaloftheChemicalSociety,1923,vol.123,p.1272

[5]AustralianJournalofChemistry,1976,vol.29,p.2003-2021

[6]ChemistryofNaturalCompounds,1986,vol.22,p.435-438    KhimiyaPrirodnykhSoedinenii,1986,vol.22,p.465-469

[1]MonatsheftefurChemie,1960,vol.91,p.1152-1161

[2]JournalofOrganicChemistry,1967,vol.32,p.62-66

[1]JournalofMedicinalChemistry,1985,vol.28,p.892-896

[1]MagneticResonanceinChemistry,1992,vol.30,p.497-499

[1]BulletinoftheChemicalSocietyofJapan,1981,vol.54,p.3213-3214

Literature
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SDS
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