trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol
TL;DR: trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol (CAS 88746-47-8) 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.
(10R,11R)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2,4,6,8,12(20),13,15,17-nonaene-10,11-diol
Also Known As: trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol, trans-1,2-Dihydro-1,2-dihydroxybenzo(b)fluoranthene, Benz(e)acephenanthrylene-1,2-diol, 1,2-dihydro-, Benz(e)acephenanthrylene-1,2-diol, 1,2-dihydro-, trans-
| Molecular Formula | C20H14O2 |
|---|---|
| Molecular Weight | 286.10 g/mol |
| LogP | 2.9 |
| 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 | 484.0 |
Chemical Identifiers
| CAS Number | 88746-47-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C4=CC=CC=C4C5=C[C@H]([C@@H](C2=C53)O)O |
| InChIKey | CDGJJJOQUUUKNH-XLIONFOSSA-N |
Product Overview
trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol (CAS 88746-47-8), with molecular formula C20H14O2 and molecular weight 286.10 g/mol. IUPAC: (10R,11R)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2,4,6,8,12(20),13,15,17-nonaene-10,11-diol.
Chemical Property Profile of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol
Property Insights of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol. With a topological polar surface area (TPSA) of 40.5 Ų, trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol 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-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol?
The CAS number of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol is 88746-47-8.
What is the molecular formula of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol?
The molecular formula of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol is C20H14O2.
What is the molecular weight of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol?
The molecular weight of trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol is 286.10 g/mol.
Where can I buy trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol?
You can request a quote for trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for trans-1,2-Dihydrobenz(e)acephenanthrylene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.