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
   -2.1898   -0.2032   -1.4678 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0992   -0.2268   -0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7734   -0.6455    0.3467 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3514    0.1212   -0.0552 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1318    1.1398   -0.7563 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7229   -0.2638    0.3355 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7019    0.4895   -0.0716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1106    0.7082   -1.8045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3139    0.8199    0.2802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8803   -0.9083    0.2951 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6743   -1.4921    0.9211 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9095   -1.1369    0.9363 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5158    1.3528   -0.6658 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7082    0.2451    0.1896 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