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
    3.9849    0.1610   -0.0978 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2358    0.3346   -0.5480 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3750   -1.1342    0.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0147   -1.0029   -0.2680 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7018    0.0834    0.2038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1177    0.9182    0.9271 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1015    0.2001   -0.1661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6910   -0.6870   -0.9248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9103    1.3511    0.3180 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4592   -0.4255   -0.9373 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4258    1.1746   -0.0195 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0300   -0.3877    0.8639 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4100   -1.1654    1.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7596   -2.0617   -0.3547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1112   -1.5474   -1.2945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7151   -0.6540   -1.2292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7626    0.9566    0.8895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2659    2.0420    0.8836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3178    1.8443   -0.6018 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