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
    1.3692   -1.8207   -1.4881 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4132   -0.7815   -1.0167 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4498   -0.4075   -1.8004 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5041   -0.2560    0.2768 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2624    0.6974    0.9124 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0742    0.9952    2.1693 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3797    1.3953    0.3558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0215    2.2767    1.0661 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9282    1.2759   -0.9077 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5829   -1.6307   -2.5420 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9797   -2.8545   -1.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3542   -1.7169   -0.9527 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3157   -0.6842    0.8499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5104    1.7351    2.6813 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8933    0.5389    2.6962 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9345    1.2374   -1.0108 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