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
    2.4420   -0.0600    0.6493 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9258    0.8073   -0.3023 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6851    0.2851   -0.8257 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4088    0.0522    0.0337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2424    0.3230    1.2689 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6550   -0.4707   -0.4815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6575   -0.6745    0.3617 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7597   -0.8864    0.2132 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7305    1.8049    0.1640 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6785    0.9341   -1.1013 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6221    0.0868   -1.8486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7259   -0.6772   -1.5364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5636   -0.4610    1.4112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5907   -1.0635   -0.0097 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