1,2-Benzenedicarbonitrile, 4-methyl-


Chemical Name: 1,2-Benzenedicarbonitrile, 4-methyl-
CAS Number: 63089-50-9
Product Number: AG00EADE(AGN-PC-0KK6AF)
Synonyms:
MDL No: MFCD02093739
Molecular Formula: C9H6N2
Molecular Weight: 142.1573

Identification/Properties


Computed Properties
Molecular Weight:
142.161g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
142.053g/mol
Monoisotopic Mass:
142.053g/mol
Topological Polar Surface Area:
47.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
226
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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