Monomers
Sodium acrylate
Identifiers
IUPAC name
sodium;prop-2-enoate
InchI
InChI=1S/C3H4O2.Na/c1-2-3(4)5;/h2H,1H2,(H,4,5);/q;+1/p-1
InchI Key
NNMHYFLPFNGQFZ-UHFFFAOYSA-M
SMILES
[O-]C(=O)C=C.[Na+]
Canonical SMILES
C=CC(=O)[O-].[Na+]
Isomeric SMILES
C=CC(=O)[O-].[Na+]
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H3NaO2
Heavy Atom Count
6
Molecular Weight
94.045
Exact Molecular Weight
94.0031
Valence Electrons
28
Radical Electrons
0
tPSA
40.13
MolLogP
-4.0737
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
9 7 0 0 0 0 0 0 0 0999 V2000
2.3090 -0.5347 0.6302 O 0 0 0 0 0 1 0 0 0 0 0 0
1.1781 0.0515 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3663 1.0512 -0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1600 -0.4104 0.2933 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1709 0.2078 -0.2719 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.0000 0.0000 Na 0 0 0 0 0 15 0 0 0 0 0 0
-0.3651 -1.2886 0.9345 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9797 1.0609 -0.8956 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1777 -0.1377 -0.1109 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 2 3
4 7 1 0
5 8 1 0
5 9 1 0
M CHG 2 1 -1 6 1
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers