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365998-38-5,MFCD17926306
Catalog No.:AA00D5FO

365998-38-5 | Methyl 7-chloroisoquinoline-3-carboxylate

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250mg
97%
in stock  
$435.00   $304.00
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1g
97%
in stock  
$1,012.00   $709.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00D5FO
Chemical Name:
Methyl 7-chloroisoquinoline-3-carboxylate
CAS Number:
365998-38-5
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
MDL Number:
MFCD17926306
SMILES:
COC(=O)C1=NC=C2C=C(C=CC2=C1)Cl
Properties
Computed Properties
 
Complexity:
247  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
2.9  

Downstream Synthesis Route
365998-38-5   
7-chloroisoquinoline-3-carboxylicacidhydrochloride 

[1]Locationinpatent:experimentalpartYoshikawa,Kenji;Kobayashi,Shozo;Nakamoto,Yumi;Haginoya,Noriyasu;Komoriya,Satoshi;Yoshino,Toshiharu;Nagata,Tsutomu;Mochizuki,Akiyoshi;Watanabe,Kengo;Suzuki,Makoto;Kanno,Hideyuki;Ohta,Toshiharu[BioorganicandMedicinalChemistry,2009,vol.17,#24,p.8221-8233]

[2]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1577301,2005,A1Locationinpatent:Page/Pagecolumn96

[3]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1270557,2003,A1

[4]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1405852,2004,A1Locationinpatent:Page88

[1]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-US2005/20645,2005,A1

[2]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1405852,2004,A1Locationinpatent:Page87

[1]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1577301,2005,A1Locationinpatent:Page/Pagecolumn95

[2]CurrentPatentAssignee:SENTINELONCOLOGY-WO2010/7374,2010,A1Locationinpatent:Page/Pagecolumn45-46

(+/-)-N-Formyl-(4-chlorophenyl)alaninemethylester 
  79-37-8    365998-38-5 

[1]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1270557,2003,A1

C11H10ClNO2 
  365998-38-5 

[1]Locationinpatent:experimentalpartYoshikawa,Kenji;Kobayashi,Shozo;Nakamoto,Yumi;Haginoya,Noriyasu;Komoriya,Satoshi;Yoshino,Toshiharu;Nagata,Tsutomu;Mochizuki,Akiyoshi;Watanabe,Kengo;Suzuki,Makoto;Kanno,Hideyuki;Ohta,Toshiharu[BioorganicandMedicinalChemistry,2009,vol.17,#24,p.8221-8233]

Literature
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SDS
Tags:365998-38-5 Molecular Formula|365998-38-5 MDL|365998-38-5 SMILES|365998-38-5 Methyl 7-chloroisoquinoline-3-carboxylate