Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-
TL;DR: Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- (CAS 2093-13-2) is a chemical compound with molecular formula C20H16O2 and molecular weight 288.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7S,8R)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8-diol
Also Known As: Sid 751054, KST-1A2627, Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-, (7s,8r)-7,8,9,10-tetrahydrobenzo[pqr]tetraphene-7,8-diol, 7,8,9,10-Tetrahydrobenzo(a)pyrene-7,8-diol cis-
| Molecular Formula | C20H16O2 |
|---|---|
| Molecular Weight | 288.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 288.11502 |
| Heavy Atoms | 22 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 2093-13-2 |
|---|---|
| SMILES | C1CC2=C(C=C3C=CC4=C5C3=C2C=CC5=CC=C4)[C@@H]([C@@H]1O)O |
| InChIKey | BZKFNBASVGRQMC-XLIONFOSSA-N |
Product Overview
Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- (CAS 2093-13-2), with molecular formula C20H16O2 and molecular weight 288.12 g/mol. IUPAC: (7S,8R)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8-diol.
Chemical Property Profile of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-
Property Insights of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-
The XLogP value of 4.0 indicates that Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- 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-7,8-diol, 7,8,9,10-tetrahydro-, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- 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-7,8-diol, 7,8,9,10-tetrahydro-, cis-?
The CAS number of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- is 2093-13-2.
What is the molecular formula of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-?
The molecular formula of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- is C20H16O2.
What is the molecular weight of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-?
The molecular weight of Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- is 288.12 g/mol.
Where can I buy Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis-?
You can request a quote for Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- 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-7,8-diol, 7,8,9,10-tetrahydro-, cis-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.