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
    4.0029   -0.2160   -1.0167 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1913   -0.2857   -1.2345 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4705   -0.7212    0.3605 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0722   -0.8077    0.3274 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7490    0.2595   -0.0188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1550    1.3331   -0.3077 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1945    0.1666   -0.0520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8337   -0.9380    0.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9791    1.3593   -0.4332 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3679    0.8301   -0.9913 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3121   -0.6810   -0.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5187   -0.8024   -1.8205 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8537   -0.0110    1.1090 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8515   -1.7492    0.6180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9052   -1.0284    0.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2594   -1.8056    0.5215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0577    1.2672   -0.1948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8765    1.5412   -1.5361 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6308    2.2893    0.0629 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