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
    2.4798    0.4266    0.5044 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8970   -0.1747   -0.6014 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4495    0.0196   -0.5879 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3137   -0.4794    0.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3165   -1.0737    1.4159 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7680   -0.3083    0.5602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4499    0.3079   -0.3788 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8475    1.3325    0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1612   -1.2518   -0.5565 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2699    0.2323   -1.5622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0232    0.5216   -1.3737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3141   -0.7010    1.4048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0328    0.7466   -1.2742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5200    0.4017   -0.2790 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