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
    2.6409    1.0148   -0.3771 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8466   -0.0278    0.0927 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4411    0.2453   -0.1221 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4932   -0.7273    0.3052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0800   -1.8093    0.8632 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9104   -0.5335    0.1289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3904    0.5468   -0.4321 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5602    0.6588   -0.4428 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9705   -0.1985    1.1866 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0577   -0.9822   -0.4704 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1757    1.1282   -0.5734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5879   -1.3264    0.4820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4636    0.6867   -0.5623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7670    1.3246   -0.7809 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