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
    2.6290    0.8893    0.5262 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2298    0.7926    0.3340 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6547   -0.4501    0.2145 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3975   -1.4594    0.2808 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7796   -0.6386    0.0145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2665   -1.8561   -0.0923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7057    0.5404   -0.0709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6668    1.3037    1.0945 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7747    1.2386    1.5785 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1057    1.5784   -0.2026 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1266   -0.1043    0.3793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5862   -2.6888   -0.0285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3267   -1.9808   -0.2397 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3104    1.2025   -0.8814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6960    0.1703   -0.3331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5801    1.4622    1.4630 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