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
   -2.2821   -0.0724    1.0334 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7999    0.7122   -0.0132 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3442    0.5645   -0.0435 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2333   -0.7019   -0.2402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5661   -1.6779   -0.3852 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6534   -0.9196   -0.2811 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5475    0.0204   -0.1421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1790   -0.4626    0.8080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2585    0.4311   -0.9783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0934    1.7595    0.1832 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2206    1.4112    0.0830 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0382   -1.9392   -0.4390 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6131   -0.1566   -0.1748 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2170    1.0314    0.0143 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