Monomers

Methacrylic acid methylthiomethyl ester

Identifiers

IUPAC name
methylsulfanylmethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H10O2S/c1-5(2)6(7)8-4-9-3/h1,4H2,2-3H3
InchI Key
AHJQXEBSKMYLKC-UHFFFAOYSA-N
SMILES
CSCOC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OCSC
Isomeric SMILES
CC(=C)C(=O)OCSC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10O2S
Heavy Atom Count
9
Molecular Weight
146.211
Exact Molecular Weight
146.0402
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.4262
H Bond Acceptors
3
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
    3.5622    0.5986   -0.1434 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8577   -0.8068   -1.0087 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3910   -1.4300   -0.1868 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3178   -0.4939   -0.2306 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9135   -0.7741    0.3491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0129   -1.9032    0.9116 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0412    0.1386    0.3353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1701   -0.1992    0.9053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9398    1.4625   -0.3195 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5073    0.8780   -0.6858 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8201    1.4437   -0.2083 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8502    0.3612    0.8926 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1101   -2.3873   -0.6953 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5769   -1.6602    0.8829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0120    0.4674    0.9010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2506   -1.1580    1.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2339    2.1224    0.2561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4998    1.3550   -1.3212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9194    1.9854   -0.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  3
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  3 14  1  0
  8 15  1  0
  8 16  1  0
  9 17  1  0
  9 18  1  0
  9 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers