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
   -2.8384   -0.6968    0.3437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4298   -0.8721    0.3380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5496    0.0795   -0.0921 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9664    1.1834   -0.5133 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8804   -0.1589   -0.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3809   -1.3030    0.3593 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8247    0.8796   -0.5420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6415    2.0052    0.2546 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1899   -1.1047    1.3312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0467    0.3740    0.3054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2713   -1.2757   -0.5036 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7462   -2.1151    0.7200 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4433   -1.4950    0.3790 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5343    1.1264   -1.5967 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8721    0.5363   -0.5211 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9687    2.8371   -0.1889 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