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
    4.2890    0.6329    0.0135 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6057    1.2758   -0.2049 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4724   -0.0985    0.1476 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1619    0.3654   -0.0123 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8829   -0.5175    0.2066 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6288   -1.6956    0.5384 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2377   -0.0296    0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4820    1.2145   -0.3108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3500   -1.0017    0.2807 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6062    0.7144    1.0721 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2786   -0.4142   -0.3547 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9472    1.2720   -0.6415 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6257   -0.9372   -0.5918 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6168   -0.4566    1.1940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6935    1.9136   -0.4850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4977    1.5293   -0.4224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5832   -1.4500   -0.7114 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0079   -1.8186    0.9287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2399   -0.4985    0.7085 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