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
    4.0670    0.4715    0.2267 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9128    0.7647    0.9056 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8253    0.6427    0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6853   -0.7539   -0.4790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4075   -0.7599   -1.3364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6377   -0.3625   -0.4749 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9482   -0.2390   -0.8507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2301   -0.5016   -2.0543 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9472    0.1768    0.1124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6068    0.4398    1.3557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3889    0.3292   -0.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5372   -1.6474    0.5822 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2032    1.1679   -0.6505 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1392   -0.5948   -0.0631 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9284    0.6655    0.9235 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8947    1.3270   -0.7949 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8819    0.8492    0.6571 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4924   -1.0548   -1.1407 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4776    0.0114   -2.1295 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2085   -1.7369   -1.7727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2894    0.7510    2.1187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5610    0.3442    1.6668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9501   -0.3476    0.4390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5837    0.1105   -1.3096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6618    1.3733    0.0301 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1437   -1.4265    1.3155 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