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
   -3.5623    0.5171   -0.1239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8521   -0.6890   -1.2777 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3642   -1.3925   -0.5725 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3249   -0.4072   -0.4467 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8969   -0.7855    0.0833 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0370   -1.9726    0.4302 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0093    0.1445    0.2476 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1485   -0.2613    0.7568 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8735    1.5658   -0.1574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8098    1.3165    0.0278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7385    0.0671    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5236    0.9365   -0.5321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5357   -1.8324    0.4425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0015   -2.2139   -1.2238 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3044   -1.2816    1.0690 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9553    0.4387    0.8687 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0037    1.7477   -0.8227 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7040    2.2056    0.7569 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7799    1.8965   -0.7082 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