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
   -2.8371    0.5758    0.5753 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9662   -0.1651   -0.1882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5673    0.2032    0.0802 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4863   -0.4531   -0.6131 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1166   -1.3482   -1.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8897   -0.1488   -0.4063 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3173    0.7578    0.4373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4857    0.7495    1.4936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1581    0.0540   -1.2607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0999   -1.2661   -0.0794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3219    0.9388    0.7710 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6187   -0.7000   -0.9793 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6441    1.3601    1.0559 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3634    0.9547    0.5628 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