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
    4.2966    0.8053   -0.0979 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6596    1.3801    0.4537 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4561    0.1071    0.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1525    0.4504    0.3883 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8784   -0.4317    0.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5677   -1.5189   -0.4865 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2586   -0.1772    0.4594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5625    0.9436    1.0718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2957   -1.1664    0.1284 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8593    1.6372   -0.5869 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1897    0.0163   -0.8690 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8739    0.3566    0.7349 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7605   -0.8289    0.5590 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5624   -0.0748   -1.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6026    1.1223    1.3285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8219    1.6963    1.3315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9732   -1.8998   -0.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2226   -0.6927   -0.2862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6275   -1.7249    1.0378 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