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
   -2.5427   -0.0408    0.9062 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9456   -0.5532   -0.2304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4774   -0.4966   -0.1280 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1837    0.7470    0.0387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5636    1.7804    0.0918 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6087    0.8661    0.1444 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4048   -0.1794    0.0933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8682    0.2214    1.5530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2353   -1.6170   -0.3452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2153    0.0312   -1.1332 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0668   -1.3690   -0.1786 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0407    1.8593    0.2712 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4786   -0.0572    0.1761 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0650   -1.1923   -0.0294 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