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
    2.8300   -0.4864    0.2507 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4306   -0.6766    0.3093 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6342    0.4109   -0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1502    1.5107   -0.3701 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8223    0.3642   -0.0148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5526    1.4140   -0.3411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4269   -0.9336    0.3881 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7953   -0.9282    0.3860 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2530   -0.8449   -0.7278 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789   -1.0738    1.0842 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0701    0.5868    0.4279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0751    2.3377   -0.6278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6306    1.4302   -0.3465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0785   -1.6865   -0.3790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0444   -1.2583    1.3710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2211   -0.1661    0.8018 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