Sodium 4-Methoxybenzene-1-sulfinate - CAS 6462-50-6
Catalog: |
BB057744 |
Product Name: |
Sodium 4-Methoxybenzene-1-sulfinate |
CAS: |
6462-50-6 |
Synonyms: |
4-Methoxybenzenesulfinic Acid Sodium Salt; Sodium 4-Methoxybenzenesulfinate; Sodium 4-methoxyphenylsulfinate; Sodium p-Methoxybenzenesulfinate; Sodium p-Methoxyphenylsulfinate; p-Methoxybenzenesulfinic Acid Sodium Salt |
IUPAC Name: | sodium4-methoxybenzenesulfinate |
Description: | Sodium 4-Methoxybenzene-1-sulfinate is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 194.18 |
Molecular Formula: | C7H7O3SNa |
Canonical SMILES: | COC1=CC=C(C=C1)S(=O)[O-].[Na+] |
InChI: | InChI=1S/C7H8O3S.Na/c1-10-6-2-4-7(5-3-6)11(8)9/h2-5H,1H3,(H,8,9)/q+1/p-1 |
InChI Key: | JZEDOEPVMYKFAB-UHFFFAOYSA-M |
References: | Jhang, Y., et al. Tetrahedron Lett., 73, 153060 (2021); Yan, Q., et al. Org. Lett., 23, 3663 (2021). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.00135954 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.00135954 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 68.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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