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CINNAMALMALONONITRILE

CAS No.:
5439-39-4
Catalog Number:
AG00DRA6
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DRA6
Chemical Name:
CINNAMALMALONONITRILE
CAS Number:
5439-39-4
MDL Number:
MFCD01578804
IUPAC Name:
2-[(E)-3-phenylprop-2-enylidene]propanedinitrile
InChI:
InChI=1S/C12H8N2/c13-9-12(10-14)8-4-7-11-5-2-1-3-6-11/h1-8H/b7-4+
InChI Key:
BQOCYDLOAKZPQE-QPJJXVBHSA-N
NSC Number:
15107
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
180.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.21g/mol
Monoisotopic Mass:
180.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties