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
    2.8932    0.0616    0.2536 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5889    0.5948    0.1643 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5029   -0.2025   -0.1506 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7093   -1.4185   -0.3558 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8327    0.3580   -0.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9956    1.6403   -0.0147 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9646   -0.5464   -0.5817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0405   -1.5264    0.3832 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1969   -0.3800   -0.7312 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9246   -0.7322    1.0323 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5853    0.8959    0.4741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1581    2.2702    0.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9631    2.1376   -0.0612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6895   -1.0555   -1.5404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9031   -0.0214   -0.7473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8539   -2.0756    0.2861 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