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
   -2.8537    0.3176    0.1802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5512   -0.3747    0.3416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5699   -1.5518    0.7410 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3733    0.3513    0.0301 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9187   -0.1822    0.1385 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2149   -1.3894    0.5305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0551    0.6903   -0.2203 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8245    1.8595   -0.6031 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3729    0.2621   -0.1490 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9753    0.9606    1.0955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6981   -0.3779    0.0582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7681    0.9639   -0.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4766    1.3695   -0.3087 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2732   -1.7275    0.5857 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5337   -2.1675    0.8319 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0730    0.9961   -0.0392 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