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
   -2.9441    0.1354   -0.2524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6642   -0.4561   -0.3711 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5777    0.3425   -0.0262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7702    1.5197    0.3644 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7889   -0.1347   -0.1001 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9887   -1.3732   -0.5112 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8857    0.7647    0.2800 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0958    0.0930    0.1292 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2508    0.6513   -1.1839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6469   -0.7053   -0.0176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9337    0.7825    0.6348 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1441   -1.9938   -0.7792 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9999   -1.7658   -0.5794 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8029    1.1660    1.3111 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9057    1.6162   -0.4405 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1762   -0.6423    0.7700 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