![苯并[a]蒽-7-硫醇 structure](/static/products/6301/63018-57-5.webp)
苯并[a]蒽-7-硫醇
TL;DR: 苯并[a]蒽-7-硫醇 (CAS 63018-57-5) is a chemical compound with molecular formula C18H12S and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯并[a]蒽-7-硫醇
benzo[a]anthracene-7-thiol
Also Known As: Benz[a]anthracene-7-thiol, benzo[a]anthracene-7-thiol, 7-Mercaptobenz(a)anthracene, BENZ(a)ANTHRACENE-7-THIOL, TETRAPHENE-7-THIOL
| Molecular Formula | C18H12S |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.06598 |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 63018-57-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)S |
| InChIKey | BYDZSGUMFLJKLZ-UHFFFAOYSA-N |
Product Overview
苯并[a]蒽-7-硫醇 (CAS 63018-57-5), with molecular formula C18H12S and molecular weight 260.07 g/mol. IUPAC: benzo[a]anthracene-7-thiol.
Chemical Property Profile of 苯并[a]蒽-7-硫醇
Property Insights of 苯并[a]蒽-7-硫醇
The XLogP value of 5.8 indicates that 苯并(a)蒽-7-硫醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, 苯并[a]蒽-7-硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯并(a)蒽-7-硫醇 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 苯并(a)蒽-7-硫醇?
The CAS number of 苯并(a)蒽-7-硫醇 is 63018-57-5.
What is the molecular formula of 苯并(a)蒽-7-硫醇?
The molecular formula of 苯并(a)蒽-7-硫醇 is C18H12S.
What is the molecular weight of 苯并(a)蒽-7-硫醇?
The molecular weight of 苯并(a)蒽-7-硫醇 is 260.07 g/mol.
Where can I buy 苯并(a)蒽-7-硫醇?
You can request a quote for 苯并(a)蒽-7-硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯并(a)蒽-7-硫醇?
Yes, KEHONG BIO provides custom synthesis services for 苯并(a)蒽-7-硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.