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
   -2.8610    0.5127   -0.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6781   -0.2273    0.1795 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4047    0.3216    0.1177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3088    1.5453   -0.1371 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7458   -0.5347    0.3481 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6270   -1.8169    0.6143 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0982    0.0622    0.2796 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2637    1.0750    1.2131 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1143    0.5144   -1.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6545    0.0126    0.5739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7621    1.5741    0.2859 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4888   -2.4410    0.7831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3534   -2.2445    0.6628 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9004   -0.6994    0.3186 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1870    0.5548   -0.7298 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8259    1.7913    0.8430 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