Monomers

Methacrylic acid 2-hydroxy-3-methoxypropyl ester

Identifiers

IUPAC name
(2-hydroxy-3-methoxypropyl) 2-methylprop-2-enoate
InchI
InChI=1S/C8H14O4/c1-6(2)8(10)12-5-7(9)4-11-3/h7,9H,1,4-5H2,2-3H3
InchI Key
BMCVSUCDMJFKSZ-UHFFFAOYSA-N
SMILES
COCC(COC(=O)C(=C)C)O
Canonical SMILES
CC(=C)C(=O)OCC(COC)O
Isomeric SMILES
CC(=C)C(=O)OCC(COC)O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H14O4
Heavy Atom Count
12
Molecular Weight
174.196
Exact Molecular Weight
174.0892
Valence Electrons
70
Radical Electrons
0
tPSA
55.76
MolLogP
0.113
H Bond Acceptors
4
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 26 25  0  0  0  0  0  0  0  0999 V2000
    4.3299    0.8353    0.6658 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9674    0.5224    0.7959 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7255   -0.6894    0.1163 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2657   -1.0737    0.2259 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3875    0.0178   -0.3500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9845   -0.2829   -0.1891 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8993    0.6402   -0.6760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4919    1.6922   -1.2329 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3390    0.3874   -0.5402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2075    1.2537   -0.9971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8457   -0.8428    0.1110 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9983   -1.2138    1.5967 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9226   -0.0095    1.1249 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6000    1.7421    1.2160 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6416    0.8520   -0.4063 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9592   -0.6145   -0.9568 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3629   -1.4407    0.6236 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1255   -2.0305   -0.2929 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6031    0.0636   -1.4377 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5795    0.9846    0.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8846    2.1577   -1.4756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2568    1.0676   -0.8972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0533   -1.6511   -0.6251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1226   -1.2396    0.8453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8205   -0.6462    0.6357 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4367   -0.4819    2.0973 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  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  2  3
  9 11  1  0
  4 12  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  3 16  1  0
  3 17  1  0
  4 18  1  0
  5 19  1  0
  5 20  1  0
 10 21  1  0
 10 22  1  0
 11 23  1  0
 11 24  1  0
 11 25  1  0
 12 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers