Monomers

Propane, 2-(ethenylthio)-2-methyl-

Identifiers

IUPAC name
2-ethenylsulfanyl-2-methylpropane
InchI
InChI=1S/C6H12S/c1-5-7-6(2,3)4/h5H,1H2,2-4H3
InchI Key
QBBBUPLGCPJGMC-UHFFFAOYSA-N
SMILES
C=CSC(C)(C)C
Canonical SMILES
CC(C)(C)SC=C
Isomeric SMILES
CC(C)(C)SC=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H12S
Heavy Atom Count
7
Molecular Weight
116.229
Exact Molecular Weight
116.066
Valence Electrons
42
Radical Electrons
0
tPSA
0.0
MolLogP
2.6616
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

 19 18  0  0  0  0  0  0  0  0999 V2000
    2.9871   -1.4727    0.7731 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8152   -1.2946    0.2034 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5027   -0.5233    1.1077 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6717    0.3313    0.0356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4339   -0.6230   -0.8502 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0522    1.3696   -0.7464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6993    1.0054    0.9360 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1684   -1.1476    1.8121 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7988   -1.9305    0.2632 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6618   -1.6177   -0.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0010   -0.0280   -1.5905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1623   -1.2324   -0.2833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7686   -1.3043   -1.4097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6066    2.2347   -0.9400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3513    0.9275   -1.7313 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9858    1.7276   -0.2754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5749    2.1088    0.9604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6584    0.6507    1.9645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7466    0.8185    0.5781 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
  4  7  1  0
  1  8  1  0
  1  9  1  0
  2 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
  7 17  1  0
  7 18  1  0
  7 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers