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
    3.9217    0.3334   -0.9022 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1226    0.3462   -1.0780 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4260   -0.7413    0.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0379   -0.8124    0.1503 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7418    0.3219    0.3228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1035    1.4011    0.5120 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1975    0.2847    0.2904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9099    1.3789    0.4575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8738   -1.0133    0.0645 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2778   -0.4639   -0.2074 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2426    1.3051   -0.4458 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4567    0.2496   -1.8530 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8433   -0.4347    1.1652 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8423   -1.7651   -0.0052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9882    1.3365    0.4310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4229    2.3223    0.6216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9491   -0.9922    0.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3179   -1.7666    0.6810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6663   -1.2902   -1.0019 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