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
   -1.9569   -0.0609   -1.5414 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6505   -1.1038   -0.6904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2259   -1.0085   -0.3948 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2356    0.1857    0.2325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5943    1.1011    0.5040 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6387    0.3626    0.5614 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0554    1.4630    1.1380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6642    0.5133   -1.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2525   -0.9970    0.2586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8226   -2.0734   -1.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4457   -1.7968   -0.6361 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3593   -0.4034    0.3387 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0879    1.5819    1.3749 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3442    2.2360    1.3655 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