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
    4.5404    0.5006    0.1564 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1736    0.4337    0.5032 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5569   -0.3251   -0.4815 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0866   -0.4918   -0.2568 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3398    0.8212   -0.3433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0528    0.6521   -0.2312 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7167    0.1164    0.8320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0595   -0.2714    1.8183 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1673   -0.0259    0.8717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7865   -0.5525    1.9234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9523    0.4299   -0.2902 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6051   -1.2777   -1.3289 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8835   -0.5610    0.1434 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6595    0.8808   -0.8731 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1149    1.1076    0.8705 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0157   -1.3381   -0.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7157    0.1614   -1.4661 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8467   -0.9863    0.6903 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7080    1.5072    0.4601 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5255    1.3400   -1.3054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2057   -0.8867    2.7763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8503   -0.6690    1.9794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3050    0.4917   -1.1887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7770   -0.2630   -0.5515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4342    1.4193   -0.0938 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5353   -2.2133   -1.0118 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