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
    2.3140   -0.0666    1.3861 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9906    0.0576    0.0347 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5327    0.2211   -0.0351 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3394   -0.7675    0.4640 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2031   -1.7887    0.9682 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7708   -0.5864    0.3852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3997    0.4485   -0.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2637    0.8292    1.7840 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2978   -0.8058   -0.5690 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4495    0.9998   -0.3114 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1678    1.0950   -0.4679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3832   -1.3852    0.7878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8266    1.2671   -0.5371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4994    0.4819   -0.1330 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