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Home Nitro Compounds 6946-15-2
6946-15-2,MFCD00007106
Catalog No.:AA003JH2

6946-15-2 | 3-Hydroxy-4-methyl-2-nitrobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$26.00   $18.00
- +
250mg
97%
in stock  
$55.00   $39.00
- +
1g
97%
in stock  
$66.00   $47.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003JH2
Chemical Name:
3-Hydroxy-4-methyl-2-nitrobenzoic acid
CAS Number:
6946-15-2
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
MDL Number:
MFCD00007106
SMILES:
[O-][N+](=O)c1c(ccc(c1O)C)C(=O)O
NSC Number:
53198
Properties
Properties
 
BP:
379.7 °C at 760 mmHg  
Form:
Solid  
MP:
185-187°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
249  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Chu,Wenhua;Kamitori,Shigehiro;Shinomiya,Miho;Carlson,RobertG.;Takusagawa,Fusao[JournaloftheAmericanChemicalSociety,1994,vol.116,#6,p.2243-2253]

[2]Brockmann;Muxfeldt[ChemischeBerichte,1958,vol.91,p.1242,1263]Angyaletal.[JournaloftheChemicalSociety,1957,p.1592,1599]

[1]Brockmann;Muxfeldt[ChemischeBerichte,1958,vol.91,p.1242,1263]Gardner;Grove[JournaloftheChemicalSociety,1953,p.3646]

[2]Angyaletal.[JournaloftheChemicalSociety,1957,p.1592,1599]

[1]Giurg,Miroslaw;Piekielska,Katarzyna;Gebala,Magdalena;Ditkowski,Bartosz;Wolanski,Marcin;Peczynska-Czoch,Wanda;Mlochowski,Jacek[SyntheticCommunications,2007,vol.37,#11,p.1779-1789]

[2]Brockmann;Muxfeldt[ChemischeBerichte,1958,vol.91,p.1242,1263]

3-hydroxy-4-methyl-2-nitro-benzonitrile 
  6946-15-2 

[1]Gardner;Grove[JournaloftheChemicalSociety,1953,p.3646]

[1]Brockmann;Lackner;Mecke;vonGrunelius;Petras;Berndt[ChemischeBerichte,1966,vol.99,#11,p.3672-3687]

Literature
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SDS
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