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
    4.0613    0.3466    0.1033 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3385    0.2144    0.6587 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4354   -0.8015   -0.5375 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0815   -0.9598   -0.1863 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7819    0.1473   -0.0555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2646    1.2588   -0.2709 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1795   -0.0278    0.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7068   -1.2170    0.5317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0511    1.1560    0.4348 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2822    1.4217   -0.0452 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2332   -0.1505   -0.8609 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7119   -0.0888    0.8947 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5712   -0.4370   -1.5781 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8925   -1.8178   -0.4999 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7466   -1.3461    0.8020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0310   -2.0773    0.4289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1188    0.8626    0.3545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8466    1.7958   -0.4713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8804    1.7204    1.3734 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