(4-Methoxy-3-nitro-phenyl)-acetonitrile


Chemical Name: (4-Methoxy-3-nitro-phenyl)-acetonitrile
CAS Number: 56245-07-9
Product Number: AG00DK40(AGN-PC-0WAKRR)
Synonyms:
MDL No:
Molecular Formula: C9H8N2O3
Molecular Weight: 192.1714

Identification/Properties


Computed Properties
Molecular Weight:
192.174g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
192.053g/mol
Monoisotopic Mass:
192.053g/mol
Topological Polar Surface Area:
78.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
253
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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