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
    2.9308    0.3583   -0.4285 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5350    0.5335   -0.6118 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5898   -0.2244    0.0372 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9724   -1.1111    0.8272 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7962    0.0344   -0.2194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1234    0.9784   -1.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8099   -0.7920    0.4886 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1097   -0.4397    0.1512 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2307    0.6621    0.5987 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1735   -0.7058   -0.6491 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4370    1.0598   -1.1153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3642    1.5538   -1.5507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1538    1.2016   -1.2768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6122   -0.6874    1.5812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7082   -1.8799    0.2116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1918   -0.5416   -0.8248 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