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
   -2.4410    0.4848    0.7322 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9556   -0.7777    0.4491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5035   -0.7714    0.5565 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2524    0.0968   -0.2826 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3805    0.8254   -1.0860 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6959    0.1377   -0.2118 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3488    0.9397   -0.9903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8012    0.9915    1.3261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1772   -0.9838   -0.6236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4145   -1.5853    1.0255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0746   -1.4027    1.2433 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2021   -0.5001    0.4877 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4146    0.9781   -0.9464 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8343    1.5672   -1.6796 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