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
    2.5566    1.4703   -1.5959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8909    0.1460   -1.4583 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9496   -0.6451   -0.8216 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7258   -0.1272    0.5547 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8227   -1.0112    1.3862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4817   -1.1090    0.9098 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3593   -0.0439    0.7535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9115    1.0863    1.0765 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7149   -0.1807    0.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2171   -1.3447   -0.0942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5616    1.0195    0.1272 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9764   -0.1791    1.2168 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4000    1.9903   -2.1364 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4832    2.0337   -0.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6535    1.6511   -2.1976 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3902   -1.6606   -0.7439 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0126   -0.7116   -1.4236 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3647    0.9141    0.5960 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2961   -2.0075    1.4231 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8832   -0.6088    2.4329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6046   -2.2361   -0.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2155   -1.3964   -0.4557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5444    0.8847    0.6472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8219    1.2485   -0.9402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0751    1.9285    0.5311 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1020   -1.1110    1.5326 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