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
    2.7632   -0.9510   -0.2635 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3648   -0.8416   -0.0744 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6825    0.3621   -0.2479 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3793    1.3518   -0.5834 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7536    0.4798   -0.0550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3097    1.6632   -0.2432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5847   -0.6683    0.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9259   -0.3183    0.4622 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0924   -0.4012   -1.1677 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0251   -2.0275   -0.3036 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3167   -0.5166    0.6076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3890    1.8114   -0.1120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7530    2.5405   -0.5312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5308   -1.4402   -0.4731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2610   -1.1248    1.2880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1162    0.0807    1.3596 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