萘-2-二硫代甲酸
TL;DR: 萘-2-二硫代甲酸 (CAS 4711-43-7) is a chemical compound with molecular formula C11H8S2 and molecular weight 204.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
萘-2-二硫代甲酸
naphthalene-2-carbodithioic acid
Also Known As: Naphthalene-2-carbodithioic Acid
| Molecular Formula | C11H8S2 |
|---|---|
| Molecular Weight | 204.01 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.00674 |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 4711-43-7 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)C(=S)S |
| InChIKey | AWLFSCHAGVTSIM-UHFFFAOYSA-N |
Product Overview
萘-2-二硫代甲酸 (CAS 4711-43-7), with molecular formula C11H8S2 and molecular weight 204.01 g/mol. IUPAC: naphthalene-2-carbodithioic acid.
Chemical Property Profile of 萘-2-二硫代甲酸
Property Insights of 萘-2-二硫代甲酸
The XLogP value of 4.4 indicates that 萘-2-二硫代甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.1 Ų, 萘-2-二硫代甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 萘-2-二硫代甲酸 has 1 hydrogen bond donor(s) and 2 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 萘-2-二硫代甲酸?
The CAS number of 萘-2-二硫代甲酸 is 4711-43-7.
What is the molecular formula of 萘-2-二硫代甲酸?
The molecular formula of 萘-2-二硫代甲酸 is C11H8S2.
What is the molecular weight of 萘-2-二硫代甲酸?
The molecular weight of 萘-2-二硫代甲酸 is 204.01 g/mol.
Where can I buy 萘-2-二硫代甲酸?
You can request a quote for 萘-2-二硫代甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 萘-2-二硫代甲酸?
Yes, KEHONG BIO provides custom synthesis services for 萘-2-二硫代甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.