Benzo(a)pyrene-9,10-dihydrodiol
TL;DR: Benzo(a)pyrene-9,10-dihydrodiol (CAS 24909-09-9) is a chemical compound with molecular formula C20H14O2 and molecular weight 286.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10-dihydrobenzo[a]pyrene-9,10-diol
Also Known As: benzo(a)pyrene-9,10-dihydrodiol, 9,10-Dihydro-9,10-dihydroxybenzo(a)pyrene, 9,10-dihydrobenzo[a]pyrene-9,10-diol, 9,10-Dihydrobenzo(a)pyrene-9,10-diol, cis-9,10-Dihydrobenzo[a]pyrene-diol
| Molecular Formula | C20H14O2 |
|---|---|
| Molecular Weight | 286.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.09937 |
| Heavy Atoms | 22 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 24909-09-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C(C(C=C5)O)O)C=C2 |
| InChIKey | GHARBPKRUUKTCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzo(a)pyrene-9,10-dihydrodiol (CAS 24909-09-9), with molecular formula C20H14O2 and molecular weight 286.10 g/mol. IUPAC: 9,10-dihydrobenzo[a]pyrene-9,10-diol.
Chemical Property Profile of Benzo(a)pyrene-9,10-dihydrodiol
Property Insights of Benzo(a)pyrene-9,10-dihydrodiol
The XLogP value of 3.9 indicates that Benzo(a)pyrene-9,10-dihydrodiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Benzo(a)pyrene-9,10-dihydrodiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(a)pyrene-9,10-dihydrodiol has 2 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 Benzo(a)pyrene-9,10-dihydrodiol?
The CAS number of Benzo(a)pyrene-9,10-dihydrodiol is 24909-09-9.
What is the molecular formula of Benzo(a)pyrene-9,10-dihydrodiol?
The molecular formula of Benzo(a)pyrene-9,10-dihydrodiol is C20H14O2.
What is the molecular weight of Benzo(a)pyrene-9,10-dihydrodiol?
The molecular weight of Benzo(a)pyrene-9,10-dihydrodiol is 286.10 g/mol.
Where can I buy Benzo(a)pyrene-9,10-dihydrodiol?
You can request a quote for Benzo(a)pyrene-9,10-dihydrodiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(a)pyrene-9,10-dihydrodiol?
Yes, KEHONG BIO provides custom synthesis services for Benzo(a)pyrene-9,10-dihydrodiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.