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
    3.8630    1.1041   -0.5834 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6158   -0.0443   -1.2658 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6564   -0.8847   -0.8263 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2517   -0.3073   -0.7815 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2818   -1.4076   -0.4995 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0632   -1.0899   -0.4751 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6274   -0.2602    0.4548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8956    0.2350    1.3423 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0361    0.0864    0.4783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8497   -0.3973   -0.4194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5514    0.9882    1.5195 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2570    0.7498    0.0878 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1376    0.8074    0.4736 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8159    1.6063   -0.9591 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1059    1.8867   -0.6073 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8477   -1.2467    0.2309 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6181   -1.8098   -1.4637 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9992    0.0692   -1.8159 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4118   -2.1324   -1.3681 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6203   -1.9586    0.4167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4620   -1.0559   -1.1763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9043   -0.1718   -0.4472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6253    0.8500    1.7339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3383    2.0469    1.2353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9190    0.8124    2.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7902    1.5241   -0.3375 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