Home Other Building Blocks 6947-94-0
6947-94-0,MFCD00092314
Catalog No.:AA003HMI

6947-94-0 | 2-Methyl-3-furoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$8.00   $6.00
- +
5g
97%
in stock  
$15.00   $11.00
- +
25g
97%
in stock  
$61.00   $43.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003HMI
Chemical Name:
2-Methyl-3-furoic acid
CAS Number:
6947-94-0
Molecular Formula:
C6H6O3
Molecular Weight:
126.1100
MDL Number:
MFCD00092314
SMILES:
Cc1occc1C(=O)O
NSC Number:
55881
Properties
Properties
 
BP:
231.5°C at 760 mmHg  
Form:
Solid  
MP:
102-105 °C  
Refractive Index:
1.4189 (estimate)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
122  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.9  

Downstream Synthesis Route

[1]HelveticaChimicaActa,1987,vol.70,p.1429-1438

[2]JournalofOrganicChemistry,1994,vol.59,p.2594-2598

[3]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1922,p.4,5    ChemischesZentralblatt,1922,vol.93,p.913

[4]BioorganicandMedicinalChemistry,2006,vol.14,p.1827-1837

[5]Patent:US2009/131431,2009,A1.Locationinpatent:Page/Pagecolumn120

[6]Patent:WO2007/36733,2007,A1.Locationinpatent:Page/Pagecolumn187-188

[7]JournalofMedicinalChemistry,2015,vol.58,p.3582-3592

[8]BioorganicandMedicinalChemistryLetters,2017,vol.27,p.90-93

[1]Trahanovsky,WalterS.;Huang,Yih-chuanJason;Leung,Man-kit[JournalofOrganicChemistry,1994,vol.59,#9,p.2594-2598]

[2]Gilman;Burtner[IowaStateCollegeJournalofScience,1931,vol.5,p.189,191]

[3]LeeYongRok,R.;Kim,NamSuk;Kim,ByungSo[TetrahedronLetters,1997,vol.38,#32,p.5671-5674]

[4]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-US5840917,1998,A

[5]Wang,Hongyu;Gao,Xuheng;Zhang,Xiaoxiao;Jin,Hong;Tao,Ke;Hou,Taiping[BioorganicandMedicinalChemistryLetters,2017,vol.27,#1,p.90-93]

[1]Mueller;Varga[ChemischeBerichte,1939,vol.72,p.1993,1998]Gilmanetal.[JournaloftheAmericanChemicalSociety,1934,vol.56,p.220]GarciaGonzalez[AnalesdelaRealSociedadEspanoladeFisicayQuimica,1934,vol.<B>32,p.815,829]

[1]Iwasaki,Tameo;Nishitani,Takashi;Horikawa,Hiroshi;Inoue,Ichizo[JournalofOrganicChemistry,1982,vol.47,#19,p.3799-3802]

[1]Bures,J.Edward;Keay,A.Brian[TetrahedronLetters,1988,vol.29,#11,p.1247-1250]

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Tags:6947-94-0 Molecular Formula|6947-94-0 MDL|6947-94-0 SMILES|6947-94-0 2-Methyl-3-furoic acid