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
    2.8374    0.8911   -1.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2003   -0.8121   -1.6250 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.7883   -1.3210    0.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6956   -0.5773    0.5906 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5448   -0.6152   -0.0476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6242   -1.3190   -1.0842 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6955    0.1270    0.4645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6288    0.8658    1.5481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9821    0.0415   -0.2703 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2054    1.1728   -0.5827 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9919    1.5756   -1.8146 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6552    1.0337   -2.3307 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6200   -2.4106    0.1400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6670   -1.0760    0.7053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6910    0.9193    2.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4804    1.4028    1.9088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2415    0.9944   -0.7876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8394   -0.1281    0.4418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9334   -0.7649   -1.0103 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