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
2.8411 -0.0454 0.5301 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6798 -0.5035 0.9495 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4349 0.5112 1.7231 S 0 0 0 0 0 0 0 0 0 0 0 0
-1.0931 0.4492 0.7466 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8754 1.1039 -0.6021 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5744 -0.9657 0.5156 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5375 -0.7215 0.0753 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1176 0.9951 0.6295 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4356 -1.5565 0.8338 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8572 1.0346 1.3375 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1205 2.1824 -0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1577 0.9027 -0.9598 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5346 0.6197 -1.3803 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5648 -1.2328 -0.5622 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6396 -1.0632 0.8396 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9446 -1.7102 1.0314 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