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
    2.3424    1.3423    0.3409 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9664    0.2317    1.0547 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3661   -0.9681    0.5344 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8317   -1.2542   -0.8326 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3207   -1.4222   -0.7817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3006   -0.2413   -0.3319 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6722   -0.2073   -0.2219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3237   -1.2332   -0.5272 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3982    0.9707    0.2343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7501    2.0724    0.5659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8805    0.9291    0.3262 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3127   -2.5022   -1.2919 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4492    1.4444    0.2414 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8450    1.4196   -0.6447 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0184    2.2367    0.9229 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0338   -1.7684    1.2244 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4866   -1.0722    0.4883 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0720   -0.5059   -1.5972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0828   -1.7084   -1.7673 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1381   -2.2334   -0.0194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6590    2.1016    0.4977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3290    2.9184    0.8976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2804    1.9565    0.4128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2370    0.3974   -0.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1595    0.3462    1.2398 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8897   -3.2499   -0.8350 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