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
   -2.9314   -0.3601   -0.0192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7019    0.3589    0.1030 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4816   -0.2803    0.0242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4664   -1.5121   -0.1578 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7920    0.4371    0.1467 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7740    1.7371    0.3388 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0855   -0.2563    0.0609 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2616   -0.9044   -1.1616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7253    0.4323   -0.1268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9617   -0.9204   -0.9926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1178   -1.0102    0.8340 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7122    2.2832    0.4316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1870    2.2330    0.3997 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9087    0.4134    0.3125 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0560   -1.0801    0.8309 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9830   -1.5713   -1.0243 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