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
    0.4168    2.0257   -1.5762 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0508    0.7682   -1.6812 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2288   -0.2695   -1.0953 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1023   -0.1440    0.3026 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3373    0.8555    0.9397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9236   -1.1613    0.9297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2275   -1.0505    2.2032 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0857    2.7339   -1.7395 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0404    0.7980   -1.1437 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2389    0.5419   -2.7498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1300   -1.0910   -1.6271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2916   -2.0038    0.3839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8813   -0.2108    2.8175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8423   -1.7923    2.7149 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