Monomers

Ethyl 2-(hydroxymethyl)acrylate

Identifiers

IUPAC name
ethyl 2-(hydroxymethyl)prop-2-enoate
InchI
InChI=1S/C6H10O3/c1-3-9-6(8)5(2)4-7/h7H,2-4H2,1H3
InchI Key
SYGAXBISYRORDR-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)CO
Canonical SMILES
CCOC(=O)C(=C)CO
Isomeric SMILES
CCOC(=O)C(=C)CO
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10O3
Heavy Atom Count
9
Molecular Weight
130.143
Exact Molecular Weight
130.063
Valence Electrons
52
Radical Electrons
0
tPSA
46.53
MolLogP
0.098
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

 19 18  0  0  0  0  0  0  0  0999 V2000
    2.7969    0.2762   -0.6055 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0759    0.3488    0.7060 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6850    0.4516    0.5899 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1222   -0.4916   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4652   -1.4938   -0.5131 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5754   -0.3511   -0.1351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2548   -1.2932   -0.7416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2960    0.8156    0.4198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0417    0.8357    1.7967 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7650    0.8546   -0.5847 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1947    0.6262   -1.4669 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0890   -0.7820   -0.8275 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4195    1.2827    1.2338 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4155   -0.4860    1.3450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3243   -1.2193   -0.8338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7433   -2.1416   -1.1478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3805    0.6373    0.3038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9777    1.7645   -0.0648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1910    0.3653    1.9717 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  3
  6  8  1  0
  8  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  2 14  1  0
  7 15  1  0
  7 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers