2-Naphthoic acid, S-phenyl ester
TL;DR: 2-Naphthoic acid, S-phenyl ester (CAS 28118-49-2) is a chemical compound with molecular formula C17H12OS and molecular weight 264.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-phenyl naphthalene-2-carbothioate
Also Known As: S-Phenyl 2-naphthalenethiocarboxylate, 2-Naphthalene S-phenylester, S-phenyl naphthalene-2-carbothioate, 2-NAPHTHOIC ACID, S-PHENYL ESTER, 2-Naphthalenecarboxylic acid, thio-, S-phenyl ester
| Molecular Formula | C17H12OS |
|---|---|
| Molecular Weight | 264.06 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.06088 |
| Heavy Atoms | 19 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 28118-49-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC(=O)C2=CC3=CC=CC=C3C=C2 |
| InChIKey | OONFEZOOKHKYQL-UHFFFAOYSA-N |
Product Overview
2-Naphthoic acid, S-phenyl ester (CAS 28118-49-2), with molecular formula C17H12OS and molecular weight 264.06 g/mol. IUPAC: S-phenyl naphthalene-2-carbothioate.
Chemical Property Profile of 2-Naphthoic acid, S-phenyl ester
Property Insights of 2-Naphthoic acid, S-phenyl ester
The XLogP value of 5.7 indicates that 2-Naphthoic acid, S-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 2-Naphthoic acid, S-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthoic acid, S-phenyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Naphthoic acid, S-phenyl ester?
The CAS number of 2-Naphthoic acid, S-phenyl ester is 28118-49-2.
What is the molecular formula of 2-Naphthoic acid, S-phenyl ester?
The molecular formula of 2-Naphthoic acid, S-phenyl ester is C17H12OS.
What is the molecular weight of 2-Naphthoic acid, S-phenyl ester?
The molecular weight of 2-Naphthoic acid, S-phenyl ester is 264.06 g/mol.
Where can I buy 2-Naphthoic acid, S-phenyl ester?
You can request a quote for 2-Naphthoic acid, S-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthoic acid, S-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthoic acid, S-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.