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
    4.5136    0.4115   -0.4358 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2189    0.6519   -0.0125 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6096   -0.6032    0.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1589   -0.4098    0.6267 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4421    0.3538   -0.4210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9029    0.5901   -0.2687 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9575   -0.2745   -0.1874 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7033   -1.4860   -0.2631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3407    0.1371   -0.0199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2848   -0.7666    0.0478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6562    1.5668    0.0710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6369   -1.6692    0.7654 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0501    1.3625   -0.5863 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5304   -0.1530   -1.3838 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0160   -0.2295    0.3358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1638   -1.2150    0.8886 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5802   -1.1059   -0.8218 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2622    0.1353    1.5898 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6629   -0.0968   -1.4404 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9380    1.3714   -0.5107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0996   -1.8301   -0.0144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3131   -0.4634    0.1722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6359    1.6713    0.5807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7905    2.0205   -0.9531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9098    2.1476    0.6487 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8108   -2.1169    1.6086 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