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
    2.9530   -0.2933   -0.8150 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0473   -0.0840    0.2107 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6871   -0.1656   -0.3247 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4322    0.0152    0.5349 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1784    0.2423    1.7456 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8111   -0.0580    0.0421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7984    0.1206    0.9002 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1101    0.5283   -1.3388 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1978   -0.9496    0.9218 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2183    0.8531    0.7587 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5016   -0.3555   -1.3350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0650   -0.2474   -0.9711 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8453    0.0805    0.6073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5849    0.3133    1.9279 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