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
   -2.1188    0.2750   -1.3316 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9851    0.0591    0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5561    0.1922    0.3566 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3744   -0.6729   -0.2627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0852   -1.5284   -1.0782 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7894   -0.5779    0.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2870    0.2995    0.8689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0140    1.2518   -1.4884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2293   -1.0056    0.2875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6074    0.7342    0.6480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3102    0.9264    1.0346 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4625   -1.2885   -0.4935 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3422    0.3460    1.0648 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6508    0.9891    1.3780 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