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
2.5597 -0.6558 -0.5294 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8007 0.3964 -0.3319 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8528 0.4648 1.1744 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.9196 0.1741 0.8173 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4430 1.3163 0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0226 -1.1558 0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1494 -0.7246 -1.4396 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6182 -1.4503 0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7642 1.1827 -1.0641 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4966 0.0941 1.7586 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3091 1.8329 0.4469 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6533 2.1095 -0.1319 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7837 0.9677 -1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4035 -1.2273 -0.7849 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6255 -1.9146 0.8398 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0881 -1.4101 -0.0560 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