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
    1.9524    0.7226   -1.7977 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0158    0.3053   -0.4680 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8464   -0.4513   -0.0858 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4405    0.1211   -0.1496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5066    1.3116   -0.5531 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6362   -0.6219    0.2307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8360   -0.1218    0.1828 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8934    0.7567   -2.1204 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9034   -0.3211   -0.2610 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0675    1.1768    0.2224 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9574   -1.4307    0.2399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5121   -1.6407    0.5690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7007   -0.7029    0.4728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0041    0.8963   -0.1508 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