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
    4.2147    1.0385   -0.6511 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8692    0.6839   -0.5938 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6574   -0.2120    0.4519 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1577   -0.5407    0.4337 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3722    0.7364    0.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0091    0.5705    0.6273 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7102    0.0007   -0.4138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0809   -0.3744   -1.4287 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1579   -0.1382   -0.2819 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7751    0.2710    0.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9620   -0.7515   -1.3874 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9494   -1.4236    1.4644 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7880    0.1054   -0.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5614    1.5304    0.2919 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3517    1.7684   -1.4587 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2414   -1.1401    0.3392 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8398    0.2740    1.4418 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9809   -0.9827   -0.5627 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6770    1.1707    1.5763 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6954    1.4911   -0.1626 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1872    0.7123    1.5968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8401    0.1635    0.8896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3051   -1.0346   -2.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5443   -1.5870   -0.9565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6841    0.0050   -1.7693 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8997   -2.3371    1.0629 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