o-Anisic acid, 5-(fluorosulfonyl)-
TL;DR: o-Anisic acid, 5-(fluorosulfonyl)- (CAS 2488-50-8) is a chemical compound with molecular formula C8H7FO5S and molecular weight 234.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluorosulfonyl-2-methoxybenzoic acid
Also Known As: 5-(Fluorosulfonyl)-2-methoxybenzoic acid, o-Anisic acid, 5-(fluorosulfonyl)-, 5-fluorosulfonyl-2-methoxybenzoic acid, 5-Fluorosulfonyl-O-anisic Acid, 5-Fluorosulfonyl-2-methoxy-benzoic acid
| Molecular Formula | C8H7FO5S |
|---|---|
| Molecular Weight | 234.00 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.99982 |
| Heavy Atoms | 15 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 2488-50-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)F)C(=O)O |
| InChIKey | JKEBLZKYIOYFNV-UHFFFAOYSA-N |
Product Overview
o-Anisic acid, 5-(fluorosulfonyl)- (CAS 2488-50-8), with molecular formula C8H7FO5S and molecular weight 234.00 g/mol. IUPAC: 5-fluorosulfonyl-2-methoxybenzoic acid.
Chemical Property Profile of o-Anisic acid, 5-(fluorosulfonyl)-
Property Insights of o-Anisic acid, 5-(fluorosulfonyl)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Anisic acid, 5-(fluorosulfonyl)-. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Anisic acid, 5-(fluorosulfonyl)-. Following Lipinski's Rule of Five, o-Anisic acid, 5-(fluorosulfonyl)- has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of o-Anisic acid, 5-(fluorosulfonyl)-?
The CAS number of o-Anisic acid, 5-(fluorosulfonyl)- is 2488-50-8.
What is the molecular formula of o-Anisic acid, 5-(fluorosulfonyl)-?
The molecular formula of o-Anisic acid, 5-(fluorosulfonyl)- is C8H7FO5S.
What is the molecular weight of o-Anisic acid, 5-(fluorosulfonyl)-?
The molecular weight of o-Anisic acid, 5-(fluorosulfonyl)- is 234.00 g/mol.
Where can I buy o-Anisic acid, 5-(fluorosulfonyl)-?
You can request a quote for o-Anisic acid, 5-(fluorosulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Anisic acid, 5-(fluorosulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for o-Anisic acid, 5-(fluorosulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.