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
    3.2449   -0.6992   -0.8584 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8925    0.0115    0.3898 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8579    0.4042    1.1884 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5142    0.2752    0.7359 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2652    0.8819    1.8063 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4413   -0.1123   -0.0631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8552    0.1850    0.3511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7621   -0.9780    0.4816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9650   -0.8334   -0.3410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3304    0.5975   -0.5212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6902    1.2872   -0.7925 S   0  0  0  0  0  6  0  0  0  0  0  0
   -1.5995    2.6941   -0.3754 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2170    1.0140   -2.1693 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4401   -0.5858   -1.6339 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1595   -0.2663   -1.3404 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4704   -1.7745   -0.6890 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9097    0.2341    0.9804 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6016    0.9269    2.1067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8620    0.7333    1.3389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1935   -1.8900    0.1368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9931   -1.2072    1.5631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8194   -1.2817   -1.3656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8230   -1.4045    0.1186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9551    0.7066   -1.4238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7317    1.0814    0.3760 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