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
    2.4816   -0.4544   -0.5855 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8375    0.5421    0.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4358    0.2494    0.3593 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4552    0.0814   -0.7302 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0723    0.2075   -1.8866 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8675   -0.2127   -0.5671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4469   -0.3496    0.6053 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3199   -0.7623   -0.1312 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9864    1.4872   -0.4232 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3746    0.6823    1.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1038    0.1664    1.3323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4625   -0.3225   -1.4580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5040   -0.5698    0.7237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8758   -0.2450    1.5094 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