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
   -2.7068    0.8648   -0.4815 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9928   -0.2960   -0.2075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5671    0.0703   -0.1682 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4361   -0.8945    0.0908 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0838   -2.1075    0.2935 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8290   -0.5130    0.1247 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2514    0.7008   -0.0728 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1615    1.6806   -0.3987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1735   -1.0045   -1.0628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2838   -0.7502    0.7568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2627    1.0499   -0.3303 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5556   -1.2947    0.3280 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6605    1.5782   -0.2838 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3319    0.9157   -0.0311 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