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
3.0123 -0.8246 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8293 -1.0181 -0.2031 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8254 0.3179 -0.8318 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.6962 0.4361 0.1616 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5818 -0.7486 -0.0107 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3793 1.7258 -0.1807 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6657 -1.5859 0.7502 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3921 0.2108 0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4381 -2.0188 -0.2895 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4198 0.4904 1.2564 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2523 -1.3784 -0.8833 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5108 -1.4472 0.8683 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6452 -0.5163 -0.1476 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4133 2.4323 0.6951 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4183 1.6089 -0.5349 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8459 2.3156 -0.9686 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