Monomers

N-(Hydroxymethyl)acrylamide

Identifiers

IUPAC name
N-(hydroxymethyl)prop-2-enamide
InchI
InChI=1S/C4H7NO2/c1-2-4(7)5-3-6/h2,6H,1,3H2,(H,5,7)
InchI Key
CNCOEDDPFOAUMB-UHFFFAOYSA-N
SMILES
OCNC(=O)C=C
Canonical SMILES
C=CC(=O)NCO
Isomeric SMILES
C=CC(=O)NCO
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H7NO2
Heavy Atom Count
7
Molecular Weight
101.105
Exact Molecular Weight
101.0477
Valence Electrons
40
Radical Electrons
0
tPSA
49.33
MolLogP
-0.7616
H Bond Acceptors
2
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 14 13  0  0  0  0  0  0  0  0999 V2000
   -2.3994    0.5640    0.7906 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0831    0.4291   -0.5670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8262   -0.3186   -0.6043 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3512    0.1523    0.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3021    1.2585    0.5967 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6139   -0.5812   -0.0239 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6899   -0.1039    0.5577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9911   -0.1239    1.3525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8635   -0.1415   -1.1068 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9200    1.4403   -0.9653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7906   -1.2360   -1.0975 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6857   -1.5335   -0.5255 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6281    0.8475    1.0617 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6031   -0.6531    0.5273 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  3
  1  8  1  0
  2  9  1  0
  2 10  1  0
  3 11  1  0
  6 12  1  0
  7 13  1  0
  7 14  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers