Propanedinitrile, [(4-nitrophenyl)methylene]-


Chemical Name: Propanedinitrile, [(4-nitrophenyl)methylene]-
CAS Number: 2700-23-4
Product Number: AG00BER4(AGN-PC-0JK63O)
Synonyms:
MDL No:
Molecular Formula: C10H5N3O2
Molecular Weight: 199.1656

Identification/Properties


Computed Properties
Molecular Weight:
199.169g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
199.038g/mol
Monoisotopic Mass:
199.038g/mol
Topological Polar Surface Area:
93.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
351
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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