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
    2.6497    0.5888    0.1630 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2840    0.5757   -0.1600 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4910   -0.4868    0.2456 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0396   -1.4187    0.9024 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9306   -0.5429   -0.0668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6616   -1.5613    0.3291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5285    0.5745   -0.8397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4013    1.7972   -0.1960 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9864    1.5410    0.6094 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9300   -0.2482    0.8465 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2200    0.4291   -0.7726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1970   -2.3527    0.8866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7163   -1.6612    0.1301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5928    0.3322   -1.0365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9881    0.6782   -1.8149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5845    1.7551    0.7737 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