![trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene structure](/static/products/5888/58886-98-9.webp)
trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene
TL;DR: trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene (CAS 58886-98-9) 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.
(9S,10S)-9,10-dihydrobenzo[a]pyrene-9,10-diol
Also Known As: (9S,10S)-9,10-dihydrobenzo[a]pyrene-9,10-diol, trans-9,10-dihydroxy-9,10-dihydrobenzo[a]pyrene, 9,10-Dihydro-9alpha,10beta-dihydroxybenzo[a]pyrene, (9S,10S)-9,10-dihydrobenzo[pqr]tetraphene-9,10-diol, (3S,4S)-pentacyclo[10.6.2.02,7.09,19.016,20]icosa-1,5,7,9,11,13,15,17,19-nonaene-3,4-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 | 58886-98-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@@H]([C@H](C=C5)O)O)C=C2 |
| InChIKey | GHARBPKRUUKTCI-OXJNMPFZSA-N |
Product Overview
trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene (CAS 58886-98-9), with molecular formula C20H14O2 and molecular weight 286.10 g/mol. IUPAC: (9S,10S)-9,10-dihydrobenzo[a]pyrene-9,10-diol.
Chemical Property Profile of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene
Property Insights of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene
The XLogP value of 3.9 indicates that trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene 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 trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene?
The CAS number of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene is 58886-98-9.
What is the molecular formula of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene?
The molecular formula of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene is C20H14O2.
What is the molecular weight of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene?
The molecular weight of trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene is 286.10 g/mol.
Where can I buy trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene?
You can request a quote for trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene?
Yes, KEHONG BIO provides custom synthesis services for trans-9,10-Dihydroxy-9,10-dihydrobenzo[a]pyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.