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162959-94-6,MFCD16622241
Catalog No.:AA001THO

162959-94-6 | 1-(Thiophen-2-yl)cyclopropanecarboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$20.00   $14.00
- +
1g
98%
in stock  
$34.00   $24.00
- +
5g
98%
in stock  
$153.00   $107.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001THO
Chemical Name:
1-(Thiophen-2-yl)cyclopropanecarboxylic acid
CAS Number:
162959-94-6
Molecular Formula:
C8H8O2S
Molecular Weight:
168.2129
MDL Number:
MFCD16622241
SMILES:
OC(=O)C1(CC1)c1cccs1
Properties
Properties
 
Form:
Solid  
MP:
138-139°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
187  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.4  

Downstream Synthesis Route

[1]Huang,Adrian;Moretto,Alessandro;Janz,Kristin;Lowe,Michael;Bedard,PatriciaW.;Tam,Steve;Di,Li;Clerin,Valerie;Sushkova,Natalia;Tchernychev,Boris;Tsao,DesireeH.H.;KeithJr.,JamesC.;Shaw,GrayD.;Schaub,RobertG.;Wang,Qin;Kaila,Neelu[JournalofMedicinalChemistry,2010,vol.53,#16,p.6003-6017]

[2]CurrentPatentAssignee:PFIZERINC-US2003/114666,2003,A1

[3]Shi,Yongjia;Gao,Qian;Xu,Senmiao[JournaloftheAmericanChemicalSociety,2019,vol.141,#27,p.10599-10604]

162959-94-6   
CASUnavailable 

[1]Huang,Adrian;Moretto,Alessandro;Janz,Kristin;Lowe,Michael;Bedard,PatriciaW.;Tam,Steve;Di,Li;Clerin,Valerie;Sushkova,Natalia;Tchernychev,Boris;Tsao,DesireeH.H.;KeithJr.,JamesC.;Shaw,GrayD.;Schaub,RobertG.;Wang,Qin;Kaila,Neelu[JournalofMedicinalChemistry,2010,vol.53,#16,p.6003-6017]

[2]Hardegger,LeoA.;Kuhn,Bernd;Spinnler,Beat;Anselm,Lilli;Ecabert,Robert;Stihle,Martine;Gsell,Bernard;Thoma,Ralf;Diez,Joachim;Benz,Joerg;Plancher,Jean-Marc;Hartmann,Guido;Banner,DavidW.;Haap,Wolfgang;Diederich,Francois[AngewandteChemie-InternationalEdition,2011,vol.50,#1,p.314-318]

[1]Hardegger,LeoA.;Kuhn,Bernd;Spinnler,Beat;Anselm,Lilli;Ecabert,Robert;Stihle,Martine;Gsell,Bernard;Thoma,Ralf;Diez,Joachim;Benz,Joerg;Plancher,Jean-Marc;Hartmann,Guido;Banner,DavidW.;Haap,Wolfgang;Diederich,Francois[AngewandteChemie-InternationalEdition,2011,vol.50,#1,p.314-318]

[1]Hardegger,LeoA.;Kuhn,Bernd;Spinnler,Beat;Anselm,Lilli;Ecabert,Robert;Stihle,Martine;Gsell,Bernard;Thoma,Ralf;Diez,Joachim;Benz,Joerg;Plancher,Jean-Marc;Hartmann,Guido;Banner,DavidW.;Haap,Wolfgang;Diederich,Francois[AngewandteChemie-InternationalEdition,2011,vol.50,#1,p.314-318]

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SDS
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Tags:162959-94-6 Molecular Formula|162959-94-6 MDL|162959-94-6 SMILES|162959-94-6 1-(Thiophen-2-yl)cyclopropanecarboxylic acid
Catalog No.: AA001THO
162959-94-6,MFCD16622241
162959-94-6 | 1-(Thiophen-2-yl)cyclopropanecarboxylic acid
Pack Size： 250mg
Purity： 98%
in stock
$20.00 $14.00
Pack Size： 1g
Purity： 98%
in stock
$34.00 $24.00
Pack Size： 5g
Purity： 98%
in stock
$153.00 $107.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001THO
Chemical Name: 1-(Thiophen-2-yl)cyclopropanecarboxylic acid
CAS Number: 162959-94-6
Molecular Formula: C8H8O2S
Molecular Weight: 168.2129
MDL Number: MFCD16622241
SMILES: OC(=O)C1(CC1)c1cccs1
Properties
Form: Solid  
MP: 138-139°C  
Storage: Keep in dry area;Room Temperature;  
Complexity: 187  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.4  
Downstream Synthesis Route
162959-93-5    162959-94-6 

[1]Huang,Adrian;Moretto,Alessandro;Janz,Kristin;Lowe,Michael;Bedard,PatriciaW.;Tam,Steve;Di,Li;Clerin,Valerie;Sushkova,Natalia;Tchernychev,Boris;Tsao,DesireeH.H.;KeithJr.,JamesC.;Shaw,GrayD.;Schaub,RobertG.;Wang,Qin;Kaila,Neelu[JournalofMedicinalChemistry,2010,vol.53,#16,p.6003-6017]

[2]CurrentPatentAssignee:PFIZERINC-US2003/114666,2003,A1

[3]Shi,Yongjia;Gao,Qian;Xu,Senmiao[JournaloftheAmericanChemicalSociety,2019,vol.141,#27,p.10599-10604]

162959-94-6   
CASUnavailable 

[1]Huang,Adrian;Moretto,Alessandro;Janz,Kristin;Lowe,Michael;Bedard,PatriciaW.;Tam,Steve;Di,Li;Clerin,Valerie;Sushkova,Natalia;Tchernychev,Boris;Tsao,DesireeH.H.;KeithJr.,JamesC.;Shaw,GrayD.;Schaub,RobertG.;Wang,Qin;Kaila,Neelu[JournalofMedicinalChemistry,2010,vol.53,#16,p.6003-6017]

[2]Hardegger,LeoA.;Kuhn,Bernd;Spinnler,Beat;Anselm,Lilli;Ecabert,Robert;Stihle,Martine;Gsell,Bernard;Thoma,Ralf;Diez,Joachim;Benz,Joerg;Plancher,Jean-Marc;Hartmann,Guido;Banner,DavidW.;Haap,Wolfgang;Diederich,Francois[AngewandteChemie-InternationalEdition,2011,vol.50,#1,p.314-318]

162959-94-6    1268445-11-9 

[1]Hardegger,LeoA.;Kuhn,Bernd;Spinnler,Beat;Anselm,Lilli;Ecabert,Robert;Stihle,Martine;Gsell,Bernard;Thoma,Ralf;Diez,Joachim;Benz,Joerg;Plancher,Jean-Marc;Hartmann,Guido;Banner,DavidW.;Haap,Wolfgang;Diederich,Francois[AngewandteChemie-InternationalEdition,2011,vol.50,#1,p.314-318]

162959-94-6    1252638-10-0    1268444-69-4 

[1]Hardegger,LeoA.;Kuhn,Bernd;Spinnler,Beat;Anselm,Lilli;Ecabert,Robert;Stihle,Martine;Gsell,Bernard;Thoma,Ralf;Diez,Joachim;Benz,Joerg;Plancher,Jean-Marc;Hartmann,Guido;Banner,DavidW.;Haap,Wolfgang;Diederich,Francois[AngewandteChemie-InternationalEdition,2011,vol.50,#1,p.314-318]

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94079-81-9
94079-81-9
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