2-Nitrothiophene-4-carbonitrile


Chemical Name: 2-Nitrothiophene-4-carbonitrile
CAS Number: 42137-23-5
Product Number: AG003HTA(AGN-PC-0WAL5R)
Synonyms:
MDL No:
Molecular Formula: C5H2N2O2S
Molecular Weight: 154.1466

Identification/Properties


Properties
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
154.143g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
153.984g/mol
Monoisotopic Mass:
153.984g/mol
Topological Polar Surface Area:
97.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
192
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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