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Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate
TL;DR: Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate (CAS 21322-76-9) is a chemical compound with molecular formula C14H12FNO4S and molecular weight 309.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N-(4-fluorosulfonyl-2-methylphenyl)carbamate
Also Known As: Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate, phenyl N-(4-fluorosulfonyl-2-methylphenyl)carbamate
| Molecular Formula | C14H12FNO4S |
|---|---|
| Molecular Weight | 309.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.04712 |
| Heavy Atoms | 21 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 21322-76-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)F)NC(=O)OC2=CC=CC=C2 |
| InChIKey | TXENTZOZAMCDGR-UHFFFAOYSA-N |
Product Overview
Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate (CAS 21322-76-9), with molecular formula C14H12FNO4S and molecular weight 309.05 g/mol. IUPAC: phenyl N-(4-fluorosulfonyl-2-methylphenyl)carbamate.
Chemical Property Profile of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate
Property Insights of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate
The XLogP value of 3.2 indicates that Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate. Following Lipinski's Rule of Five, Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate has 1 hydrogen bond donor(s) and 5 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 Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate?
The CAS number of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate is 21322-76-9.
What is the molecular formula of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate?
The molecular formula of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate is C14H12FNO4S.
What is the molecular weight of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate?
The molecular weight of Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate is 309.05 g/mol.
Where can I buy Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate?
You can request a quote for Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl [4-(fluorosulfonyl)-2-methylphenyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.