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
    2.5334   -1.1146   -0.2619 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1919   -0.7297   -0.0347 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6518    0.4567   -0.4617 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3490    1.2708   -1.0895 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7291    0.7606   -0.1814 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2523    1.9025   -0.5914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5753   -0.2123    0.5729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5886   -1.3864   -0.1807 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6426   -2.1376    0.1467 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1825   -0.4604    0.3519 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7749   -1.0838   -1.3423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2680    2.1223   -0.3834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6626    2.6158   -1.1348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6060    0.1803    0.6543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1479   -0.4255    1.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4965   -1.7589   -0.1392 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