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
    2.8235   -0.1656    0.4390 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4390   -0.1351    0.7700 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4701   -0.1400   -0.2233 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8954   -0.1725   -1.4062 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9329   -0.1094    0.1015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3024   -0.0760    1.3731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0058   -0.1136   -0.9355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8328    0.9983   -1.7187 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0265    0.4900   -0.4558 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1457   -1.2030    0.1661 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4431    0.2400    1.2633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5715   -0.0713    2.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3284   -0.0524    1.6642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0133   -0.1413   -0.4828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8900   -1.0723   -1.4875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3662    1.7242   -1.2373 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