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
    2.6914    0.5763    0.0771 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2638    0.5436    0.0068 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5808   -0.5909    0.3794 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2043   -1.6013    0.7822 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8768   -0.5935    0.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5290   -1.6847    0.6552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6250    0.5944   -0.1778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3543    1.6860    0.6614 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0061    0.4562    1.1314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0639    1.5010   -0.3708 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0286   -0.3449   -0.4573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6066   -1.6989    0.5984 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0460   -2.5779    1.0073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3842    0.8196   -1.2296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7144    0.3974   -0.1100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7026    2.5175    0.2978 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