RefChem:326153
TL;DR: RefChem:326153 (CAS 98207-92-2) is a chemical compound with molecular formula C27H28ClNO12 and molecular weight 593.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-acetyloxy-2,3,9,10-tetramethoxy-5,6-dimethylbenzo[b]phenanthridin-6-ium-12-yl) acetate perchlorate
Also Known As: Benzo(b)phenanthridinium, 7,12-bis(acetyloxy)-5,6-dimethyl-2,3,9,10-tetramethoxy-, perchlorate, 7,12-Bis(acetyloxy)-5,6-dimethyl-2,3,9,10-tetramethoxybenzo(b)phenanthridinium perchlorate, 7,12-Diacetoxy-5,6-dimethyl-2,3,9,10-tetramethoxybenzo(b)phenanthridinium perchlorate, (7-acetyloxy-2,3,9,10-tetramethoxy-5,6-dimethylbenzo[b]phenanthridin-6-ium-12-yl) acetate perchlorate, 7,12-Bis(acetyloxy)-2,3,9,10-tetramethoxy-5,6-dimethylbenzo[b]phenanthridin-6-ium perchlorate
| Molecular Formula | C27H28ClNO12 |
|---|---|
| Molecular Weight | 593.13 g/mol |
| LogP | -0.59 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 593.13 |
| Heavy Atoms | 41 |
| Complexity | 890.0 |
Chemical Identifiers
| CAS Number | 98207-92-2 |
|---|---|
| SMILES | CC1=[N+](C2=C(C3=CC(=C(C=C3C(=C2C4=CC(=C(C=C14)OC)OC)OC(=O)C)OC)OC)OC(=O)C)C.[O-]Cl(=O)(=O)=O |
| InChIKey | XABFFPGQINJJSX-UHFFFAOYSA-M |
Product Overview
RefChem:326153 (CAS 98207-92-2), with molecular formula C27H28ClNO12 and molecular weight 593.13 g/mol. IUPAC: (7-acetyloxy-2,3,9,10-tetramethoxy-5,6-dimethylbenzo[b]phenanthridin-6-ium-12-yl) acetate perchlorate.
Chemical Property Profile of RefChem:326153
Property Insights of RefChem:326153
The XLogP value of -0.59 indicates that RefChem:326153 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting RefChem:326153 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:326153 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:326153?
The CAS number of RefChem:326153 is 98207-92-2.
What is the molecular formula of RefChem:326153?
The molecular formula of RefChem:326153 is C27H28ClNO12.
What is the molecular weight of RefChem:326153?
The molecular weight of RefChem:326153 is 593.13 g/mol.
Where can I buy RefChem:326153?
You can request a quote for RefChem:326153 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:326153?
Yes, KEHONG BIO provides custom synthesis services for RefChem:326153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.