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
3.0458 0.2197 0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9565 0.0070 -0.6856 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7648 -1.2563 -0.2523 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.7000 -0.4373 0.3947 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7873 -1.3724 0.8006 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2355 0.4805 -0.6868 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7806 0.9735 -0.1958 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2163 -0.3883 0.9197 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7840 0.6218 -1.5739 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3735 0.1776 1.2759 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7345 -2.3630 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7876 -0.9239 0.5354 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8469 -1.5321 1.9123 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4309 1.0859 -1.1469 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9367 1.1827 -0.1796 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7150 -0.1217 -1.4661 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