4b,10b,11,12-Tetrahydro-6(5H)-chrysenone
TL;DR: 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone (CAS 4912-55-4) is a chemical compound with molecular formula C18H16O and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,10b,11,12-tetrahydro-4bH-chrysen-6-one
Also Known As: 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone, NCI60_003888, 5,10b,11,12-tetrahydro-4bH-chrysen-6-one, 4b,10b,11,12-Tetrahydrochrysen-6(5H)-one
| Molecular Formula | C18H16O |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.12012 |
| Heavy Atoms | 19 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 4912-55-4 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C3C1C4=CC=CC=C4C(=O)C3 |
| InChIKey | IMCFKEKBLFADHG-UHFFFAOYSA-N |
Product Overview
4b,10b,11,12-Tetrahydro-6(5H)-chrysenone (CAS 4912-55-4), with molecular formula C18H16O and molecular weight 248.12 g/mol. IUPAC: 5,10b,11,12-tetrahydro-4bH-chrysen-6-one.
Chemical Property Profile of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone
Property Insights of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone
The XLogP value of 3.8 indicates that 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone has 0 hydrogen bond donor(s) and 1 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 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone?
The CAS number of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone is 4912-55-4.
What is the molecular formula of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone?
The molecular formula of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone is C18H16O.
What is the molecular weight of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone?
The molecular weight of 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone is 248.12 g/mol.
Where can I buy 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone?
You can request a quote for 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone?
Yes, KEHONG BIO provides custom synthesis services for 4b,10b,11,12-Tetrahydro-6(5H)-chrysenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.