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Cas Database |
| Name |
Ethenesulfonic acid,2-phenyl-, sodium salt (1:1) |
EINECS | 218-013-7 |
| CAS No. | 2039-44-3 | Density | 1.39g/cm3 |
| PSA | 65.58000 | LogP | 2.28330 |
| Solubility | Soluble in water | Melting Point |
N/A |
| Formula | C8H8NaO3S | Boiling Point | N/A |
| Molecular Weight | 206.198 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Ethenesulfonicacid, 2-phenyl-, sodium salt (6CI,7CI,8CI,9CI);Sodium1-phenylethene-2-sulfonate;Sodium b-styrenesulfonate;Styrene-2-sulfonic acid sodium salt; |
Article Data | 4 |
Ethenesulfonic acid,2-phenyl-, sodium salt (1:1) Specification
The Ethenesulfonic acid, 2-phenyl-, sodium salt (1:1), with the CAS registry number 2039-44-3, is also known as beta-Styrenesulfonic acid sodium salt. And its EINECS registry number is 218-013-7. This chemical's molecular formula is C8H8NaO3S and molecular weight is 207.2021. What's more, its IUPAC name is Sodium 2-phenylethenesulfonic acid.
Physical properties about Ethenesulfonic acid, 2-phenyl-, sodium salt (1:1) are: (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 3; (3)Rotatable Bond Count: 2; (4)Exact Mass: 207.009184; (5)MonoIsotopic Mass: 207.009184; (6)Topological Polar Surface Area: 62.8; (7)Heavy Atom Count: 13; (8)Formal Charge: 1; (9)Complexity: 242; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 0; (12)Undefined Atom StereoCenter Count: 0; (13)Defined Bond StereoCenter Count: 0; (14)Undefined Bond StereoCenter Count: 1; (15)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1) Canonical SMILES: C1=CC=C(C=C1)C=CS(=O)(=O)O.[Na+]
(2) InChI: InChI=1S/C8H8O3S.Na/c9-12(10,11)7-6-8-4-2-1-3-5-8;/h1-7H,(H,9,10,11);/q;+1
(3) InChIKey: MNCGMVDMOKPCSQ-UHFFFAOYSA-N
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