Home Nitros Thiophene, 3-(2-nitro-1-propenyl)-

Thiophene, 3-(2-nitro-1-propenyl)-

CAS No.:
149977-36-6
Catalog Number:
AG007XQA
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG007XQA
Chemical Name:
Thiophene, 3-(2-nitro-1-propenyl)-
CAS Number:
149977-36-6
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
MDL Number:
MFCD01364322
IUPAC Name:
3-(2-nitroprop-1-enyl)thiophene
InChI:
InChI=1S/C7H7NO2S/c1-6(8(9)10)4-7-2-3-11-5-7/h2-5H,1H3
InChI Key:
XZGOEBZNMJQGQL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C(=Cc1cscc1)C
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.198g/mol
Monoisotopic Mass:
169.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.2  
Literature
Title Journal
In vitro activity of thienyl-2-nitropropene compounds against Trypanosoma cruzi. Memorias do Instituto Oswaldo Cruz 20091101
Properties