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
    2.3779    1.5457   -0.8847 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0776    0.9905   -0.8179 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7383    0.0492    0.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6424   -0.2847    0.9498 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5935   -0.5355    0.2308 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8325   -1.4249    1.1759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6577   -0.1448   -0.7157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8280   -0.8196   -0.4480 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3060    2.6393   -1.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9517    1.0735   -1.7017 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8786    1.4433    0.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8206   -1.8518    1.2326 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0631   -1.7327    1.8902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3375   -0.3095   -1.7833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8434    0.9434   -0.5833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9960   -1.5814   -1.0546 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