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
    2.6723    0.7014    0.1437 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3183    0.3654    0.3161 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5101   -0.1606   -0.6734 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0286   -0.3519   -1.8134 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8639   -0.4653   -0.3769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6471   -0.9636   -1.2969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4098   -0.2222    0.9635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3281    1.1190    1.3322 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9215    0.7606   -0.9505 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8703    1.7087    0.6074 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3568   -0.0349    0.5948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6957   -1.1956   -1.0689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3346   -1.1769   -2.3131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7809   -0.8209    1.6815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4511   -0.6057    1.0648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1668    1.3427    1.7891 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