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
    3.9296   -0.5398   -0.1166 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1349   -0.6313   -0.3240 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4373    1.0134    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0416    0.9292   -0.1555 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6983    0.0575    0.6310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0840   -0.6245    1.4631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1426   -0.0019    0.4315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7409    0.7478   -0.4692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9152   -0.9247    1.2660 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1944   -0.2138    0.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3388   -1.5508   -0.3290 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3911    0.2128   -0.8017 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7137    1.2893    1.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8432    1.7073   -0.7473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8097    0.6672   -0.5782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2366    1.4490   -1.1184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3827   -1.1192    2.2151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9312   -0.5504    1.5156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0833   -1.9171    0.7722 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