Thiophene, 2-[(1E)-2-nitroethenyl]-


Chemical Name: Thiophene, 2-[(1E)-2-nitroethenyl]-
CAS Number: 34312-77-1
Product Number: AG00I6RY(AGN-PC-0O94HC)
Synonyms:
MDL No:
Molecular Formula: C6H5NO2S
Molecular Weight: 155.1744

Identification/Properties


Computed Properties
Molecular Weight:
155.171g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
155.004g/mol
Monoisotopic Mass:
155.004g/mol
Topological Polar Surface Area:
74.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
152
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H319-H335
Precautionary Statements:
P261-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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