Monomers

Methacryloxysulfolane

Identifiers

IUPAC name
(1,1-dioxothiolan-2-yl) 2-methylprop-2-enoate
InchI
InChI=1S/C8H12O4S/c1-6(2)8(9)12-7-4-3-5-13(7,10)11/h7H,1,3-5H2,2H3
InchI Key
WPTHNYUICULUIA-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OC1CCCS1(=O)=O
Canonical SMILES
CC(=C)C(=O)OC1CCCS1(=O)=O
Isomeric SMILES
CC(=C)C(=O)OC1CCCS1(=O)=O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H12O4S
Heavy Atom Count
13
Molecular Weight
204.247
Exact Molecular Weight
204.0456
Valence Electrons
74
Radical Electrons
0
tPSA
60.44
MolLogP
0.6404
H Bond Acceptors
4
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0

MOL File


     RDKit          3D

 25 25  0  0  0  0  0  0  0  0999 V2000
   -3.9645   -1.1223   -0.3379 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8612   -0.2357    0.0871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1170    0.8308    0.8124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5016   -0.5835   -0.3221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2685   -1.6108   -1.0191 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3983    0.1800    0.0232 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8725   -0.2469   -0.4252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5008    0.8873   -1.1710 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9353    0.9532   -0.9671 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3749    0.3316    0.3002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9772   -0.5298    0.9322 S   0  0  0  0  0  6  0  0  0  0  0  0
    1.4743    0.0668    2.2029 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3162   -1.9872    1.0751 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7685   -2.1556    0.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9274   -0.8072    0.1317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0402   -1.1714   -1.4456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1328    1.0602    1.0985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3608    1.5190    1.1559 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8376   -1.1735   -1.0207 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2761    0.6972   -2.2613 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9919    1.8638   -0.9519 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2687    2.0332   -0.9484 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4879    0.5232   -1.8534 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2185   -0.3839    0.0867 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8090    1.0616    1.0283 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  2  0
 11  7  1  0
  1 14  1  0
  1 15  1  0
  1 16  1  0
  3 17  1  0
  3 18  1  0
  7 19  1  0
  8 20  1  0
  8 21  1  0
  9 22  1  0
  9 23  1  0
 10 24  1  0
 10 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers