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
    3.1535   -0.0978   -0.5134 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310   -0.7275   -0.4098 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8431    0.2371   -0.2474 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5036   -0.1957   -0.1212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6917   -1.4497   -0.1586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6207    0.7376    0.0429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8324    0.2468    0.1518 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9703    0.8720   -0.6777 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7556   -1.3609   -1.2852 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9909   -1.4134    0.4844 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717    1.2458   -0.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3848    1.7757    0.0651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6506    0.9265    0.2718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0322   -0.7963    0.1254 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