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
    3.2807    0.3203    0.6352 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5811   -0.6216   -0.7205 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3009    0.2358   -1.6258 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1281    0.4776   -0.8886 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6162   -0.5637   -0.3498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1563   -1.7346   -0.5738 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8358   -0.3752    0.4188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4888   -1.4018    0.8981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3384    0.9982    0.6547 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5530    0.4806    1.4853 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0815   -0.3311    1.0952 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7721    1.2665    0.3252 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0027   -0.4109   -2.4967 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6274    1.2058   -2.0650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1274   -2.3969    0.7263 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3864   -1.2529    1.4642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5490    1.5628    1.2128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5855    1.5058   -0.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2436    1.0354    1.2572 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