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306977-91-3,MFCD00215274
Catalog No.:AA0030WN

306977-91-3 | 2-Chloro-6-(4-methoxyphenyl)nicotinonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
500mg
>90%
1 week  
$1,087.00   $761.00
- +
1g
>90%
1 week  
$1,960.00   $1,372.00
- +
5g
>90%
1 week  
$7,194.00   $5,036.00
- +
10g
>90%
1 week  
$13,302.00   $9,311.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0030WN
Chemical Name:
2-Chloro-6-(4-methoxyphenyl)nicotinonitrile
CAS Number:
306977-91-3
Molecular Formula:
C13H9ClN2O
Molecular Weight:
244.6764
MDL Number:
MFCD00215274
SMILES:
COc1ccc(cc1)c1ccc(c(n1)Cl)C#N
Properties
Properties
 
Form:
Solid  
MP:
148℃  

Computed Properties
 
Complexity:
293  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.2  

Downstream Synthesis Route

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

[2]Gao,Liang;Gao,Lina;He,Fengjun;Hu,Lihong;Kang,Di;Liu,Jian;Wang,Ping;Wen,Yu;Zhou,Jingxian[EuropeanJournalofMedicinalChemistry,2020,vol.192]

[1]Locationinpatent:experimentalpartLi;Hong;Su[OrganicPreparationsandProceduresInternational,2009,vol.41,#6,p.533-538]

[2]Asokan;Anabha;Thomas,AjithDain;Jose,AnnMaria;Lethesh;Prasanth;Krishanraj[TetrahedronLetters,2007,vol.48,#32,p.5641-5643]

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

Literature
Quotation Request
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SDS
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306977-91-3

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Tags:306977-91-3 Molecular Formula|306977-91-3 MDL|306977-91-3 SMILES|306977-91-3 2-Chloro-6-(4-methoxyphenyl)nicotinonitrile
Catalog No.: AA0030WN
306977-91-3,MFCD00215274
306977-91-3 | 2-Chloro-6-(4-methoxyphenyl)nicotinonitrile
Pack Size： 1mg
Purity： >90%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >90%
1 week
$319.00 $223.00
Pack Size： 10mg
Purity： >90%
1 week
$358.00 $250.00
Pack Size： 500mg
Purity： >90%
1 week
$1,087.00 $761.00
Pack Size： 1g
Purity： >90%
1 week
$1,960.00 $1,372.00
Pack Size： 5g
Purity： >90%
1 week
$7,194.00 $5,036.00
Pack Size： 10g
Purity： >90%
1 week
$13,302.00 $9,311.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0030WN
Chemical Name: 2-Chloro-6-(4-methoxyphenyl)nicotinonitrile
CAS Number: 306977-91-3
Molecular Formula: C13H9ClN2O
Molecular Weight: 244.6764
MDL Number: MFCD00215274
SMILES: COc1ccc(cc1)c1ccc(c(n1)Cl)C#N
Properties
Form: Solid  
MP: 148℃  
Complexity: 293  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.2  
Downstream Synthesis Route
147269-06-5    306977-91-3 

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

306977-91-3    951907-79-2 

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

[2]Gao,Liang;Gao,Lina;He,Fengjun;Hu,Lihong;Kang,Di;Liu,Jian;Wang,Ping;Wen,Yu;Zhou,Jingxian[EuropeanJournalofMedicinalChemistry,2020,vol.192]

33513-42-7    100-06-1    109-77-3    306977-91-3 

[1]Locationinpatent:experimentalpartLi;Hong;Su[OrganicPreparationsandProceduresInternational,2009,vol.41,#6,p.533-538]

[2]Asokan;Anabha;Thomas,AjithDain;Jose,AnnMaria;Lethesh;Prasanth;Krishanraj[TetrahedronLetters,2007,vol.48,#32,p.5641-5643]

18096-70-3    306977-91-3 

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

100-06-1    306977-91-3 

[1]Witherington,Jason;Bordas,Vincent;Gaiba,Alessandra;Garton,NeilS.;Naylor,Antoinette;Rawlings,AnthonyD.;Slingsby,BrianP.;Smith,DavidG.;Takle,AndrewK.;Ward,RobertW.[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.3055-3057]

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