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
    2.7226    0.2509   -0.4983 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3180    0.4157   -0.4491 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5191   -0.5750    0.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1407   -1.6026    0.5413 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9245   -0.4708    0.1844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6318   -1.4386    0.7163 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5988    0.7343   -0.3354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1123    1.8348    0.3694 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1093    0.5224    0.5260 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9757   -0.8066   -0.7313 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1894    0.9133   -1.2418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1106   -2.3180    1.0929 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7254   -1.3880    0.7921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3001    0.8420   -1.3987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6972    0.6562   -0.2149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8741    2.4300    0.5448 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