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
    2.9579   -0.2705   -0.1988 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6576    0.2315   -0.5120 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5149   -0.2495    0.0501 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6351   -1.1966    0.8967 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8313    0.2479   -0.2539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9631    1.2168   -1.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0284   -0.3498    0.4200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9577   -0.2066    1.7991 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5915    0.0065   -1.0926 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3899    0.2753    0.6526 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9598   -1.3577   -0.1071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1052    1.6326   -1.5907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9368    1.5886   -1.3499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9261    0.1972    0.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0946   -1.4281    0.1692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8637   -0.3375    2.1526 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