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
   -2.0768   -0.8466   -1.7045 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9632    0.0391   -0.6375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5567    0.4217   -0.4424 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4275   -0.5664   -0.1531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0235   -1.7607   -0.0853 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8140   -0.2525    0.0469 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2931    0.9631   -0.0187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1527   -1.7867   -1.3459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3993   -0.4242    0.2409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5434    0.9413   -0.8983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3070    1.4186   -0.5207 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4903   -1.0659    0.2621 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3499    1.1175    0.1441 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6479    1.8017   -0.2317 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