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
    3.0095    0.7155   -0.3554 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6636   -1.0041   -0.5960 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4759   -1.7867    0.4548 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1542   -1.4046    0.2575 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3550   -0.1566    0.4325 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3522    0.7999    0.8113 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7794    0.1471    0.1843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5732   -0.8250   -0.2111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3270    1.5061    0.3673 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3114    1.3730   -0.9089 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0354    0.9991   -0.7807 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0031    1.0416    0.7076 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6108   -2.8956    0.3177 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6776   -1.6250    1.5510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6218   -0.6721   -0.4094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2174   -1.8465   -0.3615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5119    2.2536    0.4186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9722    1.5671    1.2631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9359    1.8131   -0.5237 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