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
   -2.8793    0.7679    0.7604 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9537   -0.1787    0.3117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6596    0.4549    0.2401 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4862   -0.2644   -0.1868 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3900   -1.4694   -0.5103 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7947    0.3677   -0.2617 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8684   -0.2843   -0.6554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7557    0.4897    0.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2549   -0.6512   -0.6363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9732   -1.0027    1.0802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5032    1.4641    0.4962 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8741    1.4148    0.0202 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8242    0.2142   -0.6996 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7419   -1.3226   -0.9256 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