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
    2.7481   -0.2046   -0.6504 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3519    0.0200   -0.6160 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5868   -0.3358    0.4818 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1966   -0.8658    1.4397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8427   -0.1282    0.5674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4769   -0.5029    1.6569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6291    0.4916   -0.5243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5309   -0.2523   -1.7081 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1428    0.0669   -1.6410 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2972    0.3747    0.0994 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9629   -1.2863   -0.4801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9474   -0.9600    2.4818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5564   -0.3698    1.7751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2383    1.5263   -0.7614 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6720    0.6264   -0.2397 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3927   -0.6960   -1.8813 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