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996-95-2,MFCD00027231
Catalog No.:AA01A254

996-95-2 | ethyl 2-cyanohex-2-enoate

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Technical Information
Catalog Number:
AA01A254
Chemical Name:
ethyl 2-cyanohex-2-enoate
CAS Number:
996-95-2
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
MDL Number:
MFCD00027231
SMILES:
CCCC=C(C(=O)OCC)C#N
Properties
Computed Properties
 
Complexity:
222  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
5  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.1  

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SDS
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Tags:996-95-2 Molecular Formula|996-95-2 MDL|996-95-2 SMILES|996-95-2 ethyl 2-cyanohex-2-enoate