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
2.7446 -0.2527 -0.0669 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7362 -0.3115 0.7597 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5780 1.0164 1.0324 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.9980 0.7111 0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7559 -0.4457 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7169 0.4591 -1.2683 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9788 0.6289 -0.6805 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4027 -1.1004 -0.1754 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5806 -1.2184 1.3228 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6365 1.6117 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5377 -0.0751 1.4906 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3368 -0.8919 -0.0786 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1337 -1.2203 1.2305 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3344 0.1020 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3590 -0.3875 -1.6141 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8807 1.3742 -1.8517 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