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
    2.3622   -1.3573    0.3439 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0329   -0.9355    0.5222 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5990    0.2061   -0.1572 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4219    0.8071   -0.9010 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7465    0.7212   -0.0414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1006    1.7904   -0.6969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7130    0.0264    0.8241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2723   -0.0125    2.1487 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5409   -1.8061   -0.6454 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6417   -2.1204    1.1137 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0918   -0.5269    0.4756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1096    2.1550   -0.5942 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4078    2.3046   -1.3292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7116    0.4984    0.8337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8493   -1.0198    0.4231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7796   -0.7308    2.6067 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