Monomers

Benzyl vinyl sulfide

Identifiers

IUPAC name
ethenylsulfanylmethylbenzene
InchI
InChI=1S/C9H10S/c1-2-10-8-9-6-4-3-5-7-9/h2-7H,1,8H2
InchI Key
RYZCGQUXJPHSSF-UHFFFAOYSA-N
SMILES
C=CSCc1ccccc1
Canonical SMILES
C=CSCC1=CC=CC=C1
Isomeric SMILES
C=CSCC1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H10S
Heavy Atom Count
10
Molecular Weight
150.246
Exact Molecular Weight
150.0503
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
3.0633
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 20 20  0  0  0  0  0  0  0  0999 V2000
   -3.9042   -0.0858   -0.1801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3330    0.9645    0.3481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5737    0.9161    0.6529 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8117   -0.1148   -0.6407 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6407   -0.1422   -0.3713 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4309    0.8245   -0.9391 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7851    0.8266   -0.7082 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2971   -0.1779    0.1108 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4969   -1.1427    0.6756 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1286   -1.1390    0.4380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3231   -0.9448   -0.4189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9590   -0.0745   -0.3700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8471    1.8790    0.6215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9553    0.3510   -1.6335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2783   -1.1152   -0.5635 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0207    1.6112   -1.5821 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4076    1.5748   -1.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3620   -0.1869    0.3002 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9074   -1.9163    1.3091 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5085   -1.9076    0.8909 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
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  5  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  4 14  1  0
  4 15  1  0
  6 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers