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
   -3.9999    0.3890   -0.9846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2711    0.8147   -0.8182 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3046   -0.6365   -0.3900 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0624   -0.3845   -0.2416 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6370    0.4699    0.6454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0937    1.1165    1.4269 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1049    0.6007    0.6507 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6727    1.4180    1.4975 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9564   -0.1680   -0.2768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6018    1.3075   -0.8104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2957   -0.3239   -0.1734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2506   -0.1167   -1.9356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6791   -1.1349    0.5284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4202   -1.3765   -1.2153 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0690    1.9826    2.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7342    1.5297    1.5202 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6710    0.5728   -0.7407 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5943   -0.9221    0.2454 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4148   -0.6312   -1.1045 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