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
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
3.1115 -0.8145 -0.7948 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8540 0.3087 0.1315 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8689 0.9247 0.6966 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5022 0.7309 0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2850 1.7003 1.2177 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3691 0.1529 -0.1213 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9353 0.5648 0.1589 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7665 0.8876 -1.0239 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5654 -0.3064 -1.4239 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1739 -0.9150 -0.2107 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8171 -0.7711 0.9604 S 0 0 0 0 0 6 0 0 0 0 0 0
-2.2901 -0.4090 2.3102 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0597 -2.0449 0.9021 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5328 -0.7156 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1772 -0.8330 -1.0842 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8816 -1.8086 -0.3354 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8719 0.6281 0.4981 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6701 1.7404 1.3688 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9726 1.4250 0.8764 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1844 1.2212 -1.9047 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4785 1.7324 -0.7971 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0018 -1.0472 -2.0241 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3956 0.0501 -2.0864 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0777 -0.4102 0.1521 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4057 -1.9915 -0.3978 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