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
   -4.3489    0.8360    0.9049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9960    0.8063    0.5816 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7210   -0.2931   -0.2511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2319   -0.2668   -0.5656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4929   -0.4200    0.7093 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8803   -0.5370    0.6494 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7808    0.3406    0.1481 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3822    1.4016   -0.3317 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2020    0.0447    0.1707 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6321   -1.0934    0.6852 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2284    0.9731   -0.3659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0072   -1.3743   -1.3926 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5879   -0.1083    1.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5100    1.7376    1.5304 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9651    0.9045   -0.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3160   -0.1525   -1.1589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9564   -1.2257    0.2844 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0647    0.6850   -1.0939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9007   -1.3015    1.2487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7377    0.4595    1.3581 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6685   -1.3730    0.7326 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9170   -1.8142    1.0948 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1270    1.0421    0.2761 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7781    1.9840   -0.4103 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5441    0.7068   -1.3940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3040   -1.9617   -1.0825 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