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
   -4.6964    0.0768   -0.5778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3331    0.2497   -0.8113 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5533   -0.5118    0.0479 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0953   -0.2076   -0.3394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2078   -1.0681    0.4783 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1514   -0.8916    0.2324 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9137    0.2309    0.4231 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3952    1.2678    0.8783 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3204    0.2091    0.0951 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8617   -0.8930   -0.3865 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1147    1.4530    0.3179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9170    1.1321   -0.1620 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2129    0.7400   -1.3301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9846    0.4413    0.4275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0265   -0.9691   -0.7236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7315   -1.6115   -0.0992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6640   -0.2143    1.1086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0340   -0.4779   -1.4333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4206   -0.8727    1.5680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4376   -2.1372    0.2382 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2508   -1.7575   -0.5279 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9081   -0.9699   -0.6502 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1585    1.3427    0.0018 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5860    2.2672   -0.2459 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9943    1.7071    1.3919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3403    1.4646    0.6640 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