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
    2.7121    0.4575   -0.4044 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3066    0.3959   -0.5501 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5996   -0.3198    0.4095 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2343   -0.8751    1.3551 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8387   -0.4623    0.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4531   -1.1493    1.3123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6296    0.1671   -0.7035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4742    1.5495   -0.7355 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0389    1.3315    0.1920 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1282    0.4811   -1.4409 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0535   -0.4933    0.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5353   -1.2790    1.3242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8475   -1.6011    2.0969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6994   -0.0416   -0.6333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3010   -0.1991   -1.7139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2944    2.0379   -0.9481 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