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
    2.6667   -0.8226    0.1359 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2719   -0.6654    0.3162 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6015    0.4294   -0.2270 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3076    1.2458   -0.8721 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8346    0.6159   -0.0564 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4068    1.6738   -0.5965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6420   -0.3591    0.7069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5871   -1.6454    0.1506 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8311   -1.2851   -0.8435 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2011    0.1481    0.1771 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1172   -1.4616    0.9125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4720    1.8330   -0.4829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8216    2.3891   -1.1550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7040   -0.0616    0.6927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3161   -0.4028    1.7833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2129   -1.6315   -0.6419 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