trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene
TL;DR: trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene (CAS 102420-56-4) is a chemical compound with molecular formula C22H14O2 and molecular weight 310.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9R,10R)-hexacyclo[16.3.1.02,7.08,21.011,20.014,19]docosa-1(22),2,4,6,8(21),11(20),12,14(19),15,17-decaene-9,10-diol
Also Known As: IP-1,2-Diol, trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene, trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2-cd)pyrene, Indeno(1,2,3-cd)pyrene-1,2-diol, 1,2-dihydro-, trans-, TRANS-1,2-DIHYDRO-1,2-DIHYDROXYINDENO[1,2-CD]PYRENE
| Molecular Formula | C22H14O2 |
|---|---|
| Molecular Weight | 310.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 310.09937 |
| Heavy Atoms | 24 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 102420-56-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC4=CC=CC5=C4C6=C(C=C5)[C@H]([C@@H](C2=C36)O)O |
| InChIKey | ZAYJHYHOTQVNOB-FGZHOGPDSA-N |
Product Overview
trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene (CAS 102420-56-4), with molecular formula C22H14O2 and molecular weight 310.10 g/mol. IUPAC: (9R,10R)-hexacyclo[16.3.1.02,7.08,21.011,20.014,19]docosa-1(22),2,4,6,8(21),11(20),12,14(19),15,17-decaene-9,10-diol.
Chemical Property Profile of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene
Property Insights of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene. With a topological polar surface area (TPSA) of 40.5 Ų, trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)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-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene?
The CAS number of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene is 102420-56-4.
What is the molecular formula of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene?
The molecular formula of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene is C22H14O2.
What is the molecular weight of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene?
The molecular weight of trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene is 310.10 g/mol.
Where can I buy trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene?
You can request a quote for trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene 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-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene?
Yes, KEHONG BIO provides custom synthesis services for trans-1,2-Dihydro-1,2-dihydroxyindeno(1,2,3-cd)pyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.