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Home Other Building Blocks 1329834-94-7
1329834-94-7,MFCD18379194
Catalog No.:AA009FSF

1329834-94-7 | N-Benzyl N-DeMethyl TriMebutine

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Technical Information
Catalog Number:
AA009FSF
Chemical Name:
N-Benzyl N-DeMethyl TriMebutine
CAS Number:
1329834-94-7
Molecular Formula:
C28H33NO5
Molecular Weight:
463.5653
MDL Number:
MFCD18379194
SMILES:
CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N(C)CC3=CC=CC=C3
Properties
Computed Properties
 
Complexity:
590  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
12  
Undefined Atom Stereocenter Count:
1  
XLogP3:
5.5  

Literature
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Additional Info:
SDS
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Tags:1329834-94-7 Molecular Formula|1329834-94-7 MDL|1329834-94-7 SMILES|1329834-94-7 N-Benzyl N-DeMethyl TriMebutine