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
    4.3869   -0.1936    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000   -1.0851    0.0678 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4828    0.1330    0.0493 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1980   -0.4579    0.0960 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9196    0.3524    0.0885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7359    1.6008    0.0393 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2879   -0.1829    0.1348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4791   -1.4809    0.1859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4337    0.7594    0.1230 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2500    0.8525   -0.3748 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1143   -0.7045   -0.6723 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8482   -0.1030    1.0085 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5838    0.7247   -0.8929 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5830    0.8122    0.9255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6337   -2.1368    0.1932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5082   -1.8617    0.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3758    0.1751    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3926    1.4547   -0.7341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4802    1.3414    1.0456 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