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
2.5125 -0.6499 0.4665 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0545 -0.3940 -0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3768 -0.7587 -1.2481 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.7344 0.4157 -0.4279 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1713 0.1870 -0.7836 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5408 0.2445 1.0831 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5377 -0.4133 0.7274 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9115 -1.0943 1.2464 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7021 0.0512 -1.4908 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4036 1.4412 -0.6912 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6806 1.1720 -0.8443 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6948 -0.3728 0.0408 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3082 -0.4138 -1.6942 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4702 -0.8184 1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4543 0.6574 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3630 0.7461 1.4419 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