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
3.1375 -0.0643 -0.1913 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9766 0.5263 0.0397 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6909 -0.4351 0.8147 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.8238 -0.2456 -0.1349 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3023 1.1608 -0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8056 -1.2892 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3383 -1.1025 0.0703 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9903 0.4522 -0.6663 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8103 1.5518 -0.2284 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5519 -0.4501 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6344 1.7852 0.6331 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3376 1.6896 -1.0122 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3153 1.2691 0.4223 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4820 -1.7992 1.2536 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8407 -2.1292 -0.4473 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8503 -0.9198 0.3712 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