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
   -2.0449    1.1466    0.9530 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0489   -0.1487    0.3951 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8697   -0.2739   -0.4203 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4037   -0.1184    0.1919 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5180    0.1273    1.4368 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5727   -0.2519   -0.6642 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7662   -0.1094   -0.1066 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3161    1.7468    0.2085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9421   -0.2081   -0.2301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0736   -0.8701    1.2399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9686   -0.4752   -1.4389 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4806   -0.4602   -1.7200 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6319   -0.2028   -0.7131 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8908    0.0981    0.9403 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