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
    3.9444   -0.6836   -0.7264 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7536   -0.3776   -1.2949 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6189   -0.4155   -0.5086 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5751    0.4768    0.6517 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3401    0.4815    1.4554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8905    0.6575    0.9070 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6815   -0.0853    0.1012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2643   -1.2105   -0.2524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0091    0.3490   -0.3883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5117    1.5178   -0.0581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8077   -0.5382   -1.2723 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6729    0.2169    1.5282 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7089   -0.6078   -1.5700 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3497    0.0531    0.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0478   -1.7348   -0.3716 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8129   -0.0446   -1.2357 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4362   -1.4661   -0.2488 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7601    1.5316    0.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3957   -0.4385    2.1365 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4540    1.3089    2.2417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4791    1.8406   -0.4116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9913    2.2269    0.5851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2701   -1.5103   -1.3923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8247   -0.7168   -0.9092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7881   -0.0590   -2.2859 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6479   -0.7719    1.6589 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