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
    3.1256    0.5213    0.6591 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4941   -1.0424   -0.0058 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4517   -0.7963   -1.4509 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2692   -0.1161   -1.0742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5848   -0.6872   -0.1431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2429   -1.8244    0.3297 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8142   -0.0466    0.2907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5817   -0.6528    1.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2116    1.2534   -0.2376 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4619    1.3217    0.3253 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1482    0.4447    1.7582 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1824    0.6459    0.3264 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9671   -0.2843   -2.2893 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1752   -1.8293   -1.8117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3439   -1.6285    1.6172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5095   -0.2082    1.5296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2955    1.4700   -0.0365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0451    1.4187   -1.3035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6461    2.0406    0.3373 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