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1341039-99-3,MFCD22209665
Catalog No.:AA00HT54

1341039-99-3 | Benzyl 3-chloro-4-cyano-6,7-dihydro-5H-pyrido[3,4-c]azepine-8(9H)-carboxylate

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Technical Information
Catalog Number:
AA00HT54
Chemical Name:
Benzyl 3-chloro-4-cyano-6,7-dihydro-5H-pyrido[3,4-c]azepine-8(9H)-carboxylate
CAS Number:
1341039-99-3
Molecular Formula:
C18H16ClN3O2
Molecular Weight:
341.7915
MDL Number:
MFCD22209665
SMILES:
N#Cc1c(Cl)ncc2c1CCCN(C2)C(=O)OCc1ccccc1
Properties
Computed Properties
 
Complexity:
486  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
XLogP3:
3.1  

Literature
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SDS
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Tags:1341039-99-3 Molecular Formula|1341039-99-3 MDL|1341039-99-3 SMILES|1341039-99-3 Benzyl 3-chloro-4-cyano-6,7-dihydro-5H-pyrido[3,4-c]azepine-8(9H)-carboxylate