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
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
2.5137 0.6613 1.1673 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3355 0.6014 0.2215 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3327 1.2868 -0.8201 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2557 -0.2406 0.5480 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.9199 -0.4543 -0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7950 -1.3275 0.3917 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2662 0.1670 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6114 0.9861 -2.0774 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5179 -0.1531 -2.0256 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4317 0.6767 0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5066 1.6137 1.7432 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5526 -0.2187 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4070 -0.7783 1.4963 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7223 -1.5433 -0.0971 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5520 -1.7926 1.3105 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9510 0.5156 -2.6398 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