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
    2.6938    0.4512    0.0499 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2826    0.4751    0.1375 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5335   -0.6350   -0.1997 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1520   -1.6550   -0.5831 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9044   -0.5676   -0.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6948   -1.5854   -0.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5160    0.7024    0.3726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1197    1.6885   -0.5578 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0929   -0.5871    0.1384 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0893    0.8900   -0.8699 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1117    1.0435    0.9040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3413   -2.5434   -0.7464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7549   -1.4478   -0.2924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0846    1.0371    1.3447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6107    0.6169    0.4182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9293    2.1166   -0.9252 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