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
   -4.0209   -0.3764   -0.1938 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2448   -0.7240   -0.1707 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4337    0.4151    0.9568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0540    0.1269    0.9592 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7468    0.1900   -0.1650 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2130    0.5240   -1.2525 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1775   -0.1210   -0.1033 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7060   -0.4665    1.0462 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9920   -0.0409   -1.3238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5384   -1.2917    0.1731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2928    0.4964    0.4392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3532   -0.1781   -1.2329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6519    1.4753    0.7280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8151    0.2055    1.9892 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7507   -0.6952    1.0990 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1174   -0.5272    1.9421 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8577   -0.7481   -1.2536 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3936   -0.2842   -2.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4497    0.9845   -1.4058 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