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
2.9695 -0.3474 0.0237 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9523 -0.9240 -0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6984 0.1268 -1.3111 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.6563 0.3567 -0.1528 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4399 -0.9013 0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5850 1.4663 -0.5107 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0600 0.7415 0.1099 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7520 -0.9429 0.4713 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9313 -2.0011 -0.6416 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2028 0.6370 0.8436 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1654 -1.1268 -0.6855 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7353 -1.7162 0.3267 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0386 -0.7137 1.0531 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5988 1.2802 -0.0724 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7311 1.6353 -1.5928 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2102 2.4296 -0.0800 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