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
    3.1538   -0.6560   -0.6428 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6423   -0.1850    1.0362 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.5231    1.2381    1.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2994    0.9491    0.3940 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5897   -0.0148    0.8305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2745   -0.6820    1.8493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8531   -0.2665    0.1504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6644   -1.1985    0.6099 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2729    0.4905   -1.0534 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7004    0.0077   -1.4011 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7685   -1.6811   -0.8153 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2544   -0.5867   -0.7801 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4504    1.6336    2.0252 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0020    2.0522    0.3809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3865   -1.7690    1.4876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6170   -1.4129    0.1257 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3855    0.8808   -1.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8792    1.4000   -0.7725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8713   -0.1995   -1.6865 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