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
    2.9390    0.2676   -0.4081 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7122   -0.3901   -0.1445 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4798    0.2391   -0.2011 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4778    1.4572   -0.5044 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7883   -0.4405    0.0714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8254   -1.7231    0.3939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0648    0.3021   -0.0098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0179    1.3549    0.9196 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3597   -0.0151   -1.3821 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6111    0.0184    0.4455 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7720    1.3759   -0.4098 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0945   -2.3097    0.4653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7545   -2.2167    0.5924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1254    0.7186   -1.0516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9229   -0.3486    0.2349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9469    1.7101    0.9883 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