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
   -2.3462    0.8055    0.5309 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9219   -0.4184    0.0920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4497   -0.4440    0.1440 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3264    0.4736   -0.5976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3420    1.3071   -1.3000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7833    0.4995   -0.5883 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4623   -0.3649    0.1397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8686    1.2691   -0.1542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3112   -1.2798    0.6354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2476   -0.5562   -0.9803 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0243   -1.1528    0.7395 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2935    1.2547   -1.2013 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5602   -0.2767    0.0899 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0371   -1.1168    0.7516 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