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
   -2.9466   -0.5009   -0.8784 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9321    0.1960   -0.2444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6380   -0.3935   -0.4709 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4984    0.2111    0.1161 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3708    1.2452    0.8219 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8085   -0.3818   -0.1105 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8573    0.1768    0.4317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7890   -0.3316   -0.4016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1970    0.2345    0.8452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9178    1.2745   -0.5621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6041   -1.2497   -1.0656 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9044   -1.2831   -0.7278 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7612    1.0526    1.0312 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8242   -0.2502    0.2719 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