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
    3.2037   -0.6873   -1.2434 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0825    0.0190   -1.5057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7539    1.1072   -0.7852 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5453    0.8415    0.6729 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6308   -0.2419    1.0425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6863   -0.2596    0.8817 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4908   -0.2453   -0.1946 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9341   -0.2172   -1.3162 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9611   -0.2608   -0.1095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6602   -0.2449   -1.2121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5764   -0.2939    1.2284 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8381    0.3881    1.1032 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1022   -0.0040   -1.3213 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3333   -1.4536   -2.0924 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2873   -1.2515   -0.3257 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6198    1.8865   -0.8070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9267    1.6581   -1.2822 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4352    1.7786    1.2653 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8325   -0.5171    2.1440 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0612   -1.1879    0.5442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2573   -0.2210   -2.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7421   -0.2568   -1.1295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0114   -1.0767    1.8149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4284    0.6487    1.7839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6501   -0.5636    1.1428 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7459   -0.1807    1.9042 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