Monomers

Propane, 2-ethenylthio-

Identifiers

IUPAC name
2-ethenylsulfanylpropane
InchI
InChI=1S/C5H10S/c1-4-6-5(2)3/h4-5H,1H2,2-3H3
InchI Key
KENPNZJNGZPRCQ-UHFFFAOYSA-N
SMILES
C=CSC(C)C
Canonical SMILES
CC(C)SC=C
Isomeric SMILES
CC(C)SC=C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H10S
Heavy Atom Count
6
Molecular Weight
102.202
Exact Molecular Weight
102.0503
Valence Electrons
36
Radical Electrons
0
tPSA
0.0
MolLogP
2.2715
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 16 15  0  0  0  0  0  0  0  0999 V2000
    3.2065    0.0168   -0.0425 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9845    0.2373    0.4026 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6980   -0.9235    0.0014 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9140   -0.1737    0.3593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9589   -1.2102   -0.0031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1184    1.1234   -0.3782 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4200   -0.8618   -0.6447 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0412    0.6907    0.1683 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7749    1.0952    0.9909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0265    0.0446    1.4395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9514   -1.9544    0.8463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6786   -1.7995   -0.9017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9673   -0.7752   -0.0533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2000    1.3026   -0.6255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4839    1.2044   -1.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8260    1.9833    0.2655 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  4  6  1  0
  1  7  1  0
  1  8  1  0
  2  9  1  0
  4 10  1  0
  5 11  1  0
  5 12  1  0
  5 13  1  0
  6 14  1  0
  6 15  1  0
  6 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers