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
   -2.4715    0.8208    0.3553 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1001   -0.3818   -0.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7446   -0.7552    0.0714 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3714    0.0775   -0.2762 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1119    1.1680   -0.8763 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7473   -0.2903    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7305    0.5001   -0.3019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2709    1.6113   -0.2119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7794   -1.1716    0.1295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1805   -0.3413   -1.3501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5680   -1.6436    0.5573 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8893   -1.2328    0.5463 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5305    1.4166   -0.8047 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7341    0.2221   -0.0700 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