anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide
TL;DR: anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide (CAS 132832-25-8) is a chemical compound with molecular formula C22H12O3 and molecular weight 324.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-oxahexacyclo[12.9.0.02,11.03,8.015,21.016,18]tricosa-1(14),2(11),3,5,7,9,12,15(21),16(18),19,22-undecaene-19,20-diol
Also Known As: anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide, syn-Benzo(c)chrysene-9,10-diol-11,12-epoxide, Benzo[9,10]chryseno[3,4-b]oxirene-12,13-diol, ANTI-BENZO[C]CHRYSENE-9,10-DIOL-11,12-EPOXIDE, SYN-BENZO[C]CHRYSENE-9,10-DIOL-11,12-EPOXIDE
| Molecular Formula | C22H12O3 |
|---|---|
| Molecular Weight | 324.08 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 324.07864 |
| Heavy Atoms | 25 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 132832-25-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C5=C(C=C4)C(=C(C6=C5O6)O)O |
| InChIKey | CTKCVENYUQHNCL-UHFFFAOYSA-N |
Product Overview
anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide (CAS 132832-25-8), with molecular formula C22H12O3 and molecular weight 324.08 g/mol. IUPAC: 17-oxahexacyclo[12.9.0.02,11.03,8.015,21.016,18]tricosa-1(14),2(11),3,5,7,9,12,15(21),16(18),19,22-undecaene-19,20-diol.
Chemical Property Profile of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide
Property Insights of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide
The XLogP value of 4.7 indicates that anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide has 2 hydrogen bond donor(s) and 3 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 anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide?
The CAS number of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide is 132832-25-8.
What is the molecular formula of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide?
The molecular formula of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide is C22H12O3.
What is the molecular weight of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide?
The molecular weight of anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide is 324.08 g/mol.
Where can I buy anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide?
You can request a quote for anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide?
Yes, KEHONG BIO provides custom synthesis services for anti-Benzo(c)chrysene-9,10-diol-11,12-epoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.