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
   -3.0598    0.5169   -0.2676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0209   -0.3880   -0.0565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7646    0.3602   -0.1372 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4990   -0.2754    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4814   -1.5103    0.2589 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7513    0.4810   -0.0478 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8817   -0.1695    0.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3131    0.9424    0.6040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0878   -1.1250   -0.9028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1394   -0.9059    0.9034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7475    1.3929   -0.3248 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7778    1.5380   -0.2393 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9341   -1.2345    0.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8077    0.3772    0.0621 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