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
    2.8254    0.2832   -0.8523 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4099    0.4216   -0.7455 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6584   -0.4990   -0.0373 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2406   -1.4622    0.5126 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7860   -0.3586    0.0722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5080   -1.2367    0.7484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4892    0.7879   -0.5810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8442    0.7581   -0.3724 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2471    1.2022   -1.2555 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1112   -0.6162   -1.4299 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1888    0.1787    0.2043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5652   -1.1341    0.8287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0606   -2.0904    1.2454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2024    0.7893   -1.6525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0898    1.7058   -0.0819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1360    1.2704    0.4297 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