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
2.2371 -1.1261 0.1978 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9728 -0.0509 -0.5236 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5323 0.1384 -1.5401 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.9825 0.3747 -0.6236 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3279 -0.8633 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9239 1.5445 0.3307 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1422 -1.1522 0.7886 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6105 -2.0012 0.2482 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6789 0.7704 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7969 0.5589 -1.3525 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3834 -1.1739 0.0248 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1346 -0.7301 1.2248 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7279 -1.7458 -0.1877 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8255 1.4618 1.0021 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0233 2.4889 -0.2364 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0479 1.5057 0.9938 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