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
   -2.5818    0.2386   -0.4647 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7962   -0.6901    0.2301 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4096   -0.5664   -0.1698 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3051    0.6434    0.0063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3164    1.6368    0.5354 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6855    0.8403   -0.3672 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3707   -0.1343   -0.9104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7759    1.0456    0.0658 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9353   -0.6164    1.3285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1797   -1.6891   -0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0739   -1.3736   -0.5929 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1814    1.7838   -0.2103 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4207   -0.0095   -1.2029 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9575   -1.1091   -1.1041 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