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
    4.0958   -0.2382   -0.3520 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0041    0.0989   -1.1093 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8931    0.5041   -0.4025 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3600   -0.5645    0.5562 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3055    0.0417    1.4231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8609    0.4504    0.8220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7503   -0.3383    0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5363   -1.5712    0.0803 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9827    0.2080   -0.4525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7977   -0.6182   -1.0688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3162    1.6300   -0.4005 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0102   -1.7050   -0.1153 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9130   -0.5312   -1.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9250   -1.1664    0.2699 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4394    0.5569    0.3410 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0993    0.7592   -1.1269 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1233    1.4227    0.1755 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2137   -0.8139    1.2550 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7840    0.9653    1.8769 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1474   -0.6161    2.3209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6072   -1.6995   -1.1451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6904   -0.2648   -1.5264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6864    1.9335   -1.4128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4713    2.2922   -0.1652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1520    1.7569    0.3441 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5377   -2.4925    0.1940 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