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
   -4.0856   -0.3927   -0.2398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4078    0.2120   -0.4499 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4109   -0.0246    1.0473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1040    0.4423    0.8948 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7962   -0.0047   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4485   -0.9063   -0.8225 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1575    0.5177   -0.1523 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5848    1.4664    0.6488 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1087    0.0072   -1.1724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4189   -0.8088   -1.2307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1800   -1.1454    0.5715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8116    0.4202   -0.0063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9038    0.3929    1.9483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3488   -1.1371    1.2039 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9138    1.8551    1.3989 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5767    1.8865    0.6032 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8696    0.7469   -1.4471 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5668   -0.3612   -2.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6488   -0.8489   -0.6825 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