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
    3.0036   -0.4706   -0.7845 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9717    0.2896   -0.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6951   -0.4169   -0.3330 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4798    0.2408    0.1225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3904    1.4272    0.5304 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7759   -0.4409    0.1212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8360    0.1929    0.5465 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6731   -0.7374   -0.1311 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1170    0.6918    0.7050 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8619    1.1706   -1.0148 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5923   -1.3997   -0.6656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8828   -1.4640   -0.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7565    1.2016    0.8928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7933   -0.2849    0.5548 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