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
    4.0409   -0.2694   -0.6048 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2748   -0.7479   -0.5061 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4806    0.4055    0.6079 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1065    0.1669    0.7890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8263    0.1859   -0.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3570    0.4409   -1.3887 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2369   -0.0584   -0.0504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0483   -0.0201   -1.0750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7786   -0.3532    1.2887 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0824    0.7759   -1.0135 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6121   -0.9355   -1.2422 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4002   -0.2052    0.4423 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7148    1.4320    0.2860 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9540    0.2983    1.6264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1169   -0.1940   -1.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6449    0.1967   -2.0550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8744   -0.2263    1.3529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4357   -1.3230    1.7006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3473    0.4309    1.9767 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