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
    4.0865    0.0512   -0.0033 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3727    0.4517   -0.4435 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3172   -0.8820    0.1622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0375   -0.6876   -0.1181 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8003    0.3765    0.3111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2161    1.2402    1.0145 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1970    0.4533   -0.0539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9203    1.4880    0.3688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7831   -0.6218   -0.8880 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1787   -1.0426    0.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8017    0.5064   -0.7175 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2760    0.4440    1.0372 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6327   -1.8132   -0.3782 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5363   -1.0361    1.2373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9555    1.5109    0.0773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5169    2.2750    0.9717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2548   -1.5974   -0.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6699   -0.3527   -1.9768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8505   -0.7636   -0.6704 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