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
    2.5667    0.9608    0.0574 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2507    0.5372    0.2767 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5586   -0.2504   -0.6256 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1527   -0.5890   -1.6790 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7979   -0.6261   -0.2897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5048   -1.3744   -1.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4118   -0.1782    0.9756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4422    1.2209    1.0184 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9736    1.3152    1.0437 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5741    1.7937   -0.6906 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2446    0.1585   -0.2731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5176   -1.6859   -0.9152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0378   -1.6911   -2.0293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8557   -0.5550    1.8639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4312   -0.5841    1.0394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3221    1.5480    1.3374 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