Monomers

Methyl 2-(hydroxymethyl)acrylate

Identifiers

IUPAC name
methyl 2-(hydroxymethyl)prop-2-enoate
InchI
InChI=1S/C5H8O3/c1-4(3-6)5(7)8-2/h6H,1,3H2,2H3
InchI Key
RFUCOAQWQVDBEU-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)CO
Canonical SMILES
COC(=O)C(=C)CO
Isomeric SMILES
COC(=O)C(=C)CO
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H8O3
Heavy Atom Count
8
Molecular Weight
116.116
Exact Molecular Weight
116.0473
Valence Electrons
46
Radical Electrons
0
tPSA
46.53
MolLogP
-0.2921
H Bond Acceptors
3
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

 16 15  0  0  0  0  0  0  0  0999 V2000
    2.7457    0.3687   -0.3391 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3365    0.4526   -0.4471 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5477   -0.5420    0.0803 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1346   -1.5156    0.6550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8960   -0.5329    0.0131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6122   -1.5135    0.5357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5964    0.5968   -0.6545 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3042    1.8125   -0.0340 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2118    1.3001   -0.7117 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0723    0.2403    0.7119 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1554   -0.4603   -0.9539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1075   -2.3190    1.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7073   -1.5017    0.4820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2946    0.6945   -1.7126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6930    0.4668   -0.5928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9927    2.4527   -0.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  5  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  6 12  1  0
  6 13  1  0
  7 14  1  0
  7 15  1  0
  8 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers