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
    3.3609    0.8166   -1.1973 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1362    0.0060    0.3744 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.6243   -0.9397    0.5026 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4615   -0.1434    0.4682 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7562   -0.8468    0.5670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7564   -2.1003    0.6767 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0165   -0.1466    0.5440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1446   -0.8019    0.6360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0327    1.3222    0.4156 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5589    0.6386   -1.9252 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3195    0.5388   -1.7150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4319    1.9396   -1.0899 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5115   -1.7268   -0.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6274   -1.4286    1.5188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1505   -1.8941    0.7318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1243   -0.3189    0.6241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0335    1.7237    0.6724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7145    1.6367   -0.6027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3029    1.7249    1.1551 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