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
   -2.3481    1.0544   -0.3475 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0972   -0.3320   -0.2753 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7038   -0.5507   -0.6299 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3617    0.0251    0.1029 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1360    0.7536    1.0969 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7602   -0.1991   -0.2595 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7534    0.3301    0.4136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6389    1.3560    0.5344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3549   -0.7336    0.7156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7302   -0.8099   -1.0539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4432   -1.1509   -1.4521 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0181   -0.8306   -1.1238 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7613    0.1365    0.1091 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5254    0.9511    1.2626 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