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
    2.1810   -1.1083   -0.6557 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0581    0.0072    0.1905 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7646    0.5760   -0.0357 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4405   -0.1317    0.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3915   -1.3126    0.5729 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6992    0.5345   -0.0861 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8193   -0.1288    0.1090 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0429   -1.1344   -1.1074 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0895   -0.3846    1.2475 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8333    0.7596    0.0216 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6972    1.5696   -0.3738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7528    1.5661   -0.4365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7843   -1.1446    0.4535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7791    0.3322   -0.0720 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