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
    2.6171    0.4012    0.5360 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2233    0.5151    0.3674 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5721   -0.4408   -0.3948 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2582   -1.3675   -0.9014 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8536   -0.4346   -0.6419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4094   -1.3704   -1.3735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6651    0.6510   -0.0498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5869    0.6735    1.3401 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9231   -0.6601    0.5414 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1911    0.9085   -0.2522 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9570    0.8646    1.5072 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4868   -1.3659   -1.5604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8715   -2.1878   -1.8322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7391    0.5800   -0.3073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3195    1.6533   -0.4137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8100    1.5800    1.6724 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