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
    3.1626    0.6219    0.1707 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6746   -0.7177    1.2483 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3098   -1.6812    0.6051 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0701   -1.0951    0.5524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3629   -0.0205   -0.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4085    0.6037   -0.8849 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7351    0.4460   -0.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1753    1.4953   -0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6836   -0.2682    0.8306 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0695    0.3979   -0.9103 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5660    1.5252    0.3950 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2611    0.8281    0.3181 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5647   -1.9998   -0.4541 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3139   -2.6491    1.1735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1669    1.8707   -0.6747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4657    2.0110   -1.3540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7285   -0.2065    0.4352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4580   -1.3481    0.9265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6246    0.1865    1.8299 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