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
   -4.7866    0.1530   -0.4221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5689   -0.5039   -0.2489 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5930    0.4872   -0.1473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2071   -0.1340    0.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2670    0.9829    0.3097 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0423    0.6589    0.6263 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9714   -0.0102   -0.1405 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6258   -0.3893   -1.2838 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3372   -0.2857    0.3432 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7341    0.0949    1.5315 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2769   -1.0103   -0.5412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8680   -0.9491   -1.0061 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6419   -0.5146   -0.5161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6652    0.7656   -1.3582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8793    0.8703    0.4278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6198    1.0382   -1.1230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8245    1.2095    0.6359 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3039   -0.7260    0.9981 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3636    1.7118   -0.5226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6749    1.5309    1.2135 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0552    0.6196    2.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7283   -0.1176    1.8565 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1794   -2.1244   -0.4194 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1019   -0.6996   -1.5800 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3356   -0.7845   -0.3106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1244   -1.8736   -0.7640 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