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
    2.9394   -0.1030   -0.7164 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -0.6207   -0.4512 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6124    0.2866   -0.3162 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8520    1.5137   -0.4324 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7595   -0.1090   -0.0432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0254   -1.3903    0.0811 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8255    0.9065    0.0907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0609    0.3620    0.3477 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5075   -0.7804   -1.3742 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8309    0.8582   -1.2793 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4421    0.1235    0.2339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2749   -2.1612   -0.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0395   -1.7015    0.2840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9189    1.4840   -0.8678 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5491    1.6090    0.8957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3805   -0.2776   -0.3039 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