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Home Other Building Blocks 3,5-DICYANOTOLUENE

3,5-DICYANOTOLUENE

CAS No.:
39718-07-5
Catalog Number:
AG003IM9
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003IM9
Chemical Name:
3,5-DICYANOTOLUENE
CAS Number:
39718-07-5
MDL Number:
MFCD00052016
IUPAC Name:
5-methylbenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C9H6N2/c1-7-2-8(5-10)4-9(3-7)6-11/h2-4H,1H3
InChI Key:
LYSGVAGOLJKEGK-UHFFFAOYSA-N
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.053g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.161g/mol
Monoisotopic Mass:
142.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Electron predators are hydrogen atom traps. Effects of aryl groups on N-C(α) bond dissociations of peptide radicals. Journal of mass spectrometry : JMS 20101101
Probing the mechanism of electron capture and electron transfer dissociation using tags with variable electron affinity. Journal of the American Chemical Society 20090422
Properties