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
   -3.9923    0.8246    0.0787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1902    0.7643    0.4182 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5136   -0.5740   -0.5688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1312   -0.7479   -0.4166 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8043    0.2334   -0.7112 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3460    1.3225   -1.1347 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2457    0.0149   -0.5391 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1218    0.9626   -0.8253 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7899   -1.2747   -0.0376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5022    1.5186    0.7677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4453   -0.1877    0.2599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1902    1.0508   -0.9828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8272   -0.4105   -1.6207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0126   -1.5165   -0.2449 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7149    1.9067   -1.1930 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1871    0.8365   -0.7108 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8279   -1.4165   -0.3374 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6663   -1.2347    1.0840 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1008   -2.0723   -0.4357 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