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
    4.2655   -0.4888    0.4638 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5838   -1.0233    0.9282 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4180    0.0519    0.0918 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0754   -0.2702    0.3788 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9121    0.5167   -0.2305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5618    1.4550   -0.9899 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3162    0.2753   -0.0068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2120    1.0279   -0.5906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7033   -0.8406    0.8958 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2242    0.6169    0.3391 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0264   -0.8310    1.1658 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5479   -0.9062   -0.5463 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5777    0.0209   -1.0178 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5805    1.0918    0.4908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9077    1.8229   -1.2343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2533    0.8489   -0.4248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2635   -0.6661    1.8902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3700   -1.7874    0.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7994   -0.9145    1.0389 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