8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene
TL;DR: 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene (CAS 36504-66-2) is a chemical compound with molecular formula C20H12O and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),6,9,11,13(21),14,16,18-nonaene
Also Known As: BP 9,10-Oxide, Benzo[a]pyrene-9,10-oxide, Benzo(a)pyrene 9,10-oxide, Benzo(a)pyrene-9,10-epoxide, Benzo[a]pyrene-9,10-epoxide
| Molecular Formula | C20H12O |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 268.0888 |
| Heavy Atoms | 21 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 36504-66-2 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C6C(O6)C=C5)C=C2 |
| InChIKey | GOEJUYABKOTLJA-UHFFFAOYSA-N |
Product Overview
8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene (CAS 36504-66-2), with molecular formula C20H12O and molecular weight 268.09 g/mol. IUPAC: 4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),6,9,11,13(21),14,16,18-nonaene.
Chemical Property Profile of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene
Property Insights of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene
The XLogP value of 4.9 indicates that 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene has 0 hydrogen bond donor(s) and 1 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 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene?
The CAS number of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene is 36504-66-2.
What is the molecular formula of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene?
The molecular formula of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene is C20H12O.
What is the molecular weight of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene?
The molecular weight of 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene is 268.09 g/mol.
Where can I buy 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene?
You can request a quote for 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene?
Yes, KEHONG BIO provides custom synthesis services for 8a,9a-Dihydrobenzo(10,11)chryseno(3,4-b)oxirene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.