Monomers

2-Acetamidoacrylic acid

Identifiers

IUPAC name
2-acetamidoprop-2-enoic acid
InchI
InChI=1S/C5H7NO3/c1-3(5(8)9)6-4(2)7/h1H2,2H3,(H,6,7)(H,8,9)
InchI Key
UFDFFEMHDKXMBG-UHFFFAOYSA-N
SMILES
CC(=O)NC(=C)C(=O)O
Canonical SMILES
CC(=O)NC(=C)C(=O)O
Isomeric SMILES
CC(=O)NC(=C)C(=O)O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H7NO3
Heavy Atom Count
9
Molecular Weight
129.115
Exact Molecular Weight
129.0426
Valence Electrons
50
Radical Electrons
0
tPSA
66.4
MolLogP
-0.2792
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

 16 15  0  0  0  0  0  0  0  0999 V2000
   -2.7494   -0.7713   -0.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2444   -0.7518   -0.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6994   -1.6523    0.5757 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5617    0.3066   -0.6245 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8324    0.5169   -0.5997 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2962    1.6235   -1.2347 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8318   -0.3000    0.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6766   -1.3534    0.6549 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1801    0.1127   -0.0873 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0519   -0.1902   -1.0748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1542   -0.3984    0.7609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0534   -1.8136   -0.3621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286    1.0569   -1.1532 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5822    2.2612   -1.7099 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3311    1.7997   -1.2287 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9126   -0.4464    0.3412 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  2  3
  5  7  1  0
  7  8  2  0
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  4 13  1  0
  6 14  1  0
  6 15  1  0
  9 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers