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
    2.7270    0.2099    0.5268 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3587   -0.1706    0.3516 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3412    0.7690    0.3013 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6256    1.9830    0.4119 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0369    0.3248    0.1209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9988    1.2361    0.0748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3656   -1.1175   -0.0096 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9702   -1.8181    1.1174 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7873    1.2971    0.3181 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9990   -0.0668    1.5490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2882   -0.3561   -0.2503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8158    2.2783    0.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0346    0.9272   -0.0592 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7349   -1.5144   -0.8598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4165   -1.2127   -0.2667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7537   -2.7691    0.9045 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