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
    3.9485   -1.2697    1.2381 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6844   -0.0656    0.7007 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.0992   -0.9085    0.4525 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1562    0.0723    0.0366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1624   -0.2433   -0.2395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4836   -1.4643   -0.0996 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1378    0.7527   -0.6665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3928    0.4468   -0.9283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7133    2.1586   -0.8139 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4088   -2.0883    1.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4409   -1.6286    0.2903 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7143   -0.7820    1.8798 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2628   -1.6703   -0.3472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7049   -1.3556    1.3877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1341    1.1452   -1.2421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6975   -0.5875   -0.8179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1450    2.4426    0.0964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5389    2.8494   -0.9894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0148    2.1960   -1.6828 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