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6970-19-0,MFCD00002505
Catalog No.:AA003IBQ

6970-19-0 | 3,4,5-Triethoxybenzoic acid

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1g
98%
in stock  
$7.00   $5.00
- +
5g
98%
in stock  
$12.00   $8.00
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25g
95%
in stock  
$37.00   $26.00
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100g
95%
in stock  
$79.00   $55.00
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500g
95%
in stock  
$261.00   $183.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IBQ
Chemical Name:
3,4,5-Triethoxybenzoic acid
CAS Number:
6970-19-0
Molecular Formula:
C13H18O5
Molecular Weight:
254.2790
MDL Number:
MFCD00002505
SMILES:
CCOc1c(OCC)cc(cc1OCC)C(=O)O
NSC Number:
66202
Properties
Properties
 
BP:
372.3°C at 760 mmHg  
Form:
Solid  
MP:
109-112 °C  
Refractive Index:
1.4825 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
240  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
2.5  

Downstream Synthesis Route

[1]Slotta;Szyszka[JournalfurpraktischeChemie(Leipzig1954),1933,vol.<2>137,p.339,349]Feist;Klatt;Awe[ArchivderPharmazie,1934,vol.272,p.221,235]

[2]Ernest,I.etal.[CollectionofCzechoslovakChemicalCommunications,1963,vol.28,p.1022-1030]

[3]Sugihara;Watanabe;Kawamatsu;Morimoto[JustusLiebigsAnnalenderChemie,1972,vol.763,p.109-120]

[1]Rabjohn;Mendel[JournalofOrganicChemistry,1957,vol.22,p.986]

6970-19-0   
1,2,3-triethoxy-5-nitro-benzene 

[1]Schiffer[ChemischeBerichte,1892,vol.25,p.722]Pollak;Goldstein[MonatsheftefurChemie,1908,vol.29,p.136]Weselsky;Benedikt[MonatsheftefurChemie,1881,vol.2,p.215]

[2]CurrentPatentAssignee:KOWACOMPANY,LTD.-US2003/27814,2003,A1

[1]Slotta;Szyszka[JournalfurpraktischeChemie(Leipzig1954),1933,vol.<2>137,p.339,349]Feist;Klatt;Awe[ArchivderPharmazie,1934,vol.272,p.221,235]

[2]Pettit,G.R.etal.[CanadianJournalofChemistry,1963,vol.41,p.2962-2968]

[3]Moffett,R.B.etal.[JournalofMedicinalChemistry,1964,vol.7,p.178-186]

[4]Locationinpatent:experimentalpartBuettner,Anita;Seifert,Katrin;Cottin,Thomas;Sarli,Vasiliki;Tzagkaroulaki,Lito;Scholz,Stefan;Giannis,Athanassios[BioorganicandMedicinalChemistry,2009,vol.17,#14,p.4943-4954]

[5]Locationinpatent:bodytextSolinas,Antonio;Faure,Hélène;Roudaut,Hermine;Traiffort,Elisabeth;Schoenfelder,Angèle;Mann,André;Manetti,Fabrizio;Taddei,Maurizio;Ruat,Martial[JournalofMedicinalChemistry,2012,vol.55,#4,p.1559-1571]

[1]Ernest,I.etal.[CollectionofCzechoslovakChemicalCommunications,1963,vol.28,p.1022-1030]

[2]CurrentPatentAssignee:EISAICOLTD-US5210239,1993,A

Literature

Title: A pyrazine bis-adduct of a binuclear rhodium(II) carboxylate containing 3,4,5-triethoxybenzoate as the equatorial ligand.

Journal: Acta crystallographica. Section C, Crystal structure communications 20020701

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Tags:6970-19-0 Molecular Formula|6970-19-0 MDL|6970-19-0 SMILES|6970-19-0 3,4,5-Triethoxybenzoic acid