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
2.9050 -0.1789 0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0606 0.0534 -0.6182 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5703 -0.8975 -0.8431 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.7160 -0.1418 0.1691 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1317 1.2308 -0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8973 -1.0603 0.2186 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8215 0.4117 0.5087 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7634 -0.9574 1.1298 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2755 0.8408 -1.3193 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3136 -0.0092 1.2128 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6936 1.6975 0.5385 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8399 1.1024 -1.1791 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2894 1.8908 -0.5424 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8575 -0.5046 0.2836 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7590 -1.7609 1.0765 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8983 -1.7168 -0.6942 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