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
    4.0403   -0.2369   -0.2562 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3001   -0.4023    0.2238 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3508    0.9911   -0.4627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0149    0.8943   -0.1070 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7536   -0.2072   -0.4930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1638   -1.0927   -1.1579 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1507   -0.3803   -0.1699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7851   -1.4592   -0.5747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8716    0.6447    0.6112 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1207    0.4398   -1.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4709   -1.2215   -0.5128 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6068    0.2679    0.5646 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7708    1.9632   -0.1468 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4654    0.9561   -1.5727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3133   -2.2464   -1.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8251   -1.6013   -0.3415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9402    0.6420    0.2770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4269    1.6465    0.4622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8805    0.4019    1.6784 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