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
    3.5979    0.2476   -0.6782 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9610    0.5983    0.9611 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4332   -0.2967    1.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3604    0.1322    0.5201 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8769   -0.4540    0.6833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0009   -1.3573    1.5645 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0435   -0.0982   -0.0935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1977   -0.6948    0.1102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9237    0.9520   -1.1276 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5630    1.1957   -1.2780 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0238   -0.5380   -1.2105 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6340   -0.1129   -0.6146 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1466   -0.0374    2.3804 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5389   -1.3928    1.2504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3500   -1.4689    0.8504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0964   -0.4426   -0.4665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0460    0.5505   -2.1500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7431    1.6902   -0.9158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9808    1.5272   -1.0412 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