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
   -3.6608    0.2355    0.7086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9486   -1.2828    0.0683 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4960   -1.0384   -0.9435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4235   -0.5323   -0.1486 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8147   -0.2612   -0.7190 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9065   -0.4937   -1.9630 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9538    0.2534    0.0173 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8712    0.5012    1.3046 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2378    0.5023   -0.7136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4005    0.6767   -0.0176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3145   -0.0606    1.5821 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9377    0.9691    1.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2025   -2.0306   -1.3592 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6330   -0.3679   -1.7992 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7186    0.8793    1.8328 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9546    0.3200    1.8199 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3715    1.6126   -0.7337 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0697   -0.0113   -0.1850 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1186    0.1289   -1.7477 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