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
    3.0758   -0.5412   -0.5050 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6721    1.0537    0.1566 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3734    1.0817    1.3806 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1311    0.8253    0.8297 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3526   -0.2965    0.2167 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3548   -1.3219    0.0889 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7248   -0.3227   -0.3095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1666   -1.4039   -0.8916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6177    0.8534   -0.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9979   -1.3235    0.2563 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4878   -0.8363   -1.4004 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1644   -0.5294   -0.8431 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5756    0.3266    2.2122 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3088    2.0750    1.9027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1616   -1.4653   -1.2895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5276   -2.2592   -0.9803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7703    1.2377   -1.2358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6109    0.4784    0.1379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2096    1.6391    0.4665 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