Benzo(a)pyrene-11,12-diol
TL;DR: Benzo(a)pyrene-11,12-diol (CAS 65277-41-0) is a chemical compound with molecular formula C20H12O2 and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[a]pyrene-11,12-diol
Also Known As: Benzo[a]pyrene-11,12-diol, Benzo(a)pyrene-11,12-diol, 11,12-Dihydroxybenzo(a)pyrene, 11,12-Dihydroxybenzo[a]pyrene, Benzo pyrene-11,12-diol
| Molecular Formula | C20H12O2 |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 5.1484 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 284.08374 |
| Heavy Atoms | 22 |
| Complexity | 1187.6934 |
Chemical Identifiers
| CAS Number | 65277-41-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C(=C(C5=CC=C4)O)O |
Product Overview
Benzo(a)pyrene-11,12-diol (CAS 65277-41-0), with molecular formula C20H12O2 and molecular weight 284.08 g/mol. IUPAC: benzo[a]pyrene-11,12-diol.
Chemical Property Profile of Benzo(a)pyrene-11,12-diol
Property Insights of Benzo(a)pyrene-11,12-diol
The XLogP value of 5.1484 indicates that Benzo(a)pyrene-11,12-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, Benzo(a)pyrene-11,12-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(a)pyrene-11,12-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo(a)pyrene-11,12-diol?
The CAS number of Benzo(a)pyrene-11,12-diol is 65277-41-0.
What is the molecular formula of Benzo(a)pyrene-11,12-diol?
The molecular formula of Benzo(a)pyrene-11,12-diol is C20H12O2.
What is the molecular weight of Benzo(a)pyrene-11,12-diol?
The molecular weight of Benzo(a)pyrene-11,12-diol is 284.08 g/mol.
Where can I buy Benzo(a)pyrene-11,12-diol?
You can request a quote for Benzo(a)pyrene-11,12-diol 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-11,12-diol?
Yes, KEHONG BIO provides custom synthesis services for Benzo(a)pyrene-11,12-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.