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29886-64-4,MFCD03783559
Catalog No.:AA00BD58

29886-64-4 | 4-(Thiophen-3-yl)benzoic acid

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100mg
95%
in stock  
$42.00   $29.00
- +
250mg
95%
in stock  
$51.00   $36.00
- +
1g
95%
in stock  
$106.00   $75.00
- +
10g
95%
in stock  
$1,009.00   $706.00
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25g
95%
in stock  
$2,007.00   $1,405.00
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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:
AA00BD58
Chemical Name:
4-(Thiophen-3-yl)benzoic acid
CAS Number:
29886-64-4
Molecular Formula:
C11H8O2S
Molecular Weight:
204.2450
MDL Number:
MFCD03783559
SMILES:
OC(=O)c1ccc(cc1)c1cscc1
Properties
Properties
 
Form:
Solid  
MP:
282 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
209  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Zhang,Jidong;Aszodi,Jozsef;Chartier,Céline;L'Hermite,Nathalie;Weston,John[TetrahedronLetters,2001,vol.42,#38,p.6683-6686]

304690-94-6    29886-64-4   
<i>N</i>-(1-methyl-1,2,3,4-tetrahydro-quinolin-7-yl)-4-thiophen-3-yl-benzamide 

[1]Westaway,SusanM.;Chung,Ying-Kit;Davis,JohnB.;Holland,Vicky;Jerman,JeffreyC.;Medhurst,StephenJ.;Rami,HarshadK.;Stemp,Geoffrey;Stevens,AlexanderJ.;Thompson,Mervyn;Winborn,KimY.;Wright,James[BioorganicandMedicinalChemistryLetters,2006,vol.16,#17,p.4533-4536]

[1]Locationinpatent:experimentalpartHolzer,Marcel;Ziegler,Sigrid;Neugebauer,Alexander;Kronenberger,Bernd;Klein,ChristianD.;Hartmann,RolfW.[ArchivderPharmazie,2008,vol.341,#8,p.478-484]

[1]Locationinpatent:experimentalpartHolzer,Marcel;Ziegler,Sigrid;Neugebauer,Alexander;Kronenberger,Bernd;Klein,ChristianD.;Hartmann,RolfW.[ArchivderPharmazie,2008,vol.341,#8,p.478-484]

[2]Kalsi,Deepti;Barsu,Nagaraju;Sundararaju,Basker[Chemistry-AEuropeanJournal,2018,vol.24,#10,p.2360-2364]

[1]Locationinpatent:experimentalpartTu,Zhude;Li,Shihong;Cui,Jinquan;Xu,Jinbin;Taylor,Michelle;Ho,David;Luedtke,RobertR.;MacH,RobertH.[JournalofMedicinalChemistry,2011,vol.54,#6,p.1555-1564]

Literature
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SDS
Tags:29886-64-4 Molecular Formula|29886-64-4 MDL|29886-64-4 SMILES|29886-64-4 4-(Thiophen-3-yl)benzoic acid