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
    3.0042   -1.1205    0.0692 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9900   -0.2652   -0.3473 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7216   -0.7739    0.1444 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4973   -0.0692   -0.1488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3786    0.9775   -0.8357 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7821   -0.5579    0.3321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8624    0.1279    0.0330 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5283   -0.7659    0.8230 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0114   -0.2917   -1.4733 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1799    0.7770   -0.0387 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6292   -1.6414    0.7129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8954   -1.4505    0.9195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8414   -0.1871    0.3627 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8073    1.0306   -0.5531 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