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168214-67-3,MFCD21496335
Catalog No.:AA00AD8G

168214-67-3 | 1,1-dimethyl-2-benzoxepin-3-yl)phenyl]ethenyl]-

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Technical Information
Catalog Number:
AA00AD8G
Chemical Name:
1,1-dimethyl-2-benzoxepin-3-yl)phenyl]ethenyl]-
CAS Number:
168214-67-3
Molecular Formula:
C29H26ClNO
Molecular Weight:
439.9758
MDL Number:
MFCD21496335
SMILES:
Clc1ccc2c(c1)nc(cc2)/C=C/c1cccc(c1)C1CCc2c(C(O1)(C)C)cccc2
Properties
Computed Properties
 
Complexity:
647  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
7.3  

Literature
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SDS
Tags:168214-67-3 Molecular Formula|168214-67-3 MDL|168214-67-3 SMILES|168214-67-3 1,1-dimethyl-2-benzoxepin-3-yl)phenyl]ethenyl]-