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
   -2.4776    0.9425    0.2201 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1012   -0.3891    0.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7856   -0.5381   -0.4784 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3492   -0.0106    0.2063 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1075    0.5859    1.3015 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6950   -0.1490   -0.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6917    0.3520    0.3479 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9484    1.5641   -0.3229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8112   -0.8450   -0.6594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1745   -0.9385    1.0261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6028   -1.0299   -1.3780 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8404   -0.6627   -1.2494 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5253    0.8608    1.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6921    0.2576   -0.0278 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