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
   -2.5493    0.3301    0.3547 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9479   -0.9253    0.2557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5228   -0.7550    0.5275 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3032    0.0868   -0.2657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2733    0.6770   -1.2189 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7275    0.2689   -0.0095 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3986    1.0626   -0.7944 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1345    0.8949    1.0365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4341   -1.5758    0.9838 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0791   -1.3684   -0.7459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0769   -1.2533    1.3183 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2158   -0.2286    0.7949 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4429    1.2148   -0.6304 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9299    1.5714   -1.6066 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