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
    3.6051    0.5160    0.3717 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6663   -0.7755    0.0256 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7468   -1.4034   -0.7147 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3252   -1.4651   -0.2533 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5673   -0.1873   -0.3867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8308   -0.3959   -0.0961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6539    0.7109   -0.1824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0985    1.8162   -0.5119 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0795    0.6546    0.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6750   -0.4607    0.4198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8723    1.8883   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2808   -2.0066    1.0241 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5131    1.2634   -0.4488 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9421    0.7470    1.1967 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6606    0.7903    0.7876 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7593   -1.0002   -1.7950 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1313   -2.4718   -0.8872 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8125   -2.2545   -0.9473 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9109    0.6114    0.2808 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6798    0.2073   -1.4196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1201   -1.3845    0.5152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7345   -0.5286    0.6211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7622    1.7275   -0.7102 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3314    2.0727    0.9767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2920    2.7573   -0.3829 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8491   -1.4289    1.5961 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