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
   -2.3258    0.1414    1.0997 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0715   -0.3466   -0.1567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8377    0.0943   -0.7286 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4180   -0.1900   -0.0891 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3675   -0.8342    0.9775 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6666    0.2650   -0.6825 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8132   -0.0001   -0.0895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4616    1.0992    1.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8979   -0.0008   -0.8369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1746   -1.4559   -0.1303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7731    0.6360   -1.6224 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6922    0.8212   -1.6057 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8182   -0.5471    0.8225 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7666    0.3177   -0.4932 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