1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene
TL;DR: 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene (CAS 55101-66-1) is a chemical compound with molecular formula C16H20 and molecular weight 212.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,3a,4,5,5a,6,7,8-decahydropyrene
Also Known As: decahydropyrene, 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene, 1,2,3,3a,4,5,5a,6,7,8-Decahydro-pyren, Pyrene, 1,2,3,3a,4,5,5a,6,7,8-decahydro-, RefChem:71230
| Molecular Formula | C16H20 |
|---|---|
| Molecular Weight | 212.16 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.1565 |
| Heavy Atoms | 16 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 55101-66-1 |
|---|---|
| SMILES | C1CC2CCC3CCCC4=C3C2=C(C1)C=C4 |
| InChIKey | MNXFZXVRYXNOBW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene (CAS 55101-66-1), with molecular formula C16H20 and molecular weight 212.16 g/mol. IUPAC: 1,2,3,3a,4,5,5a,6,7,8-decahydropyrene.
Chemical Property Profile of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene
Property Insights of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene
The XLogP value of 5.1 indicates that 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene?
The CAS number of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene is 55101-66-1.
What is the molecular formula of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene?
The molecular formula of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene is C16H20.
What is the molecular weight of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene?
The molecular weight of 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene is 212.16 g/mol.
Where can I buy 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene?
You can request a quote for 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,3a,4,5,5a,6,7,8-Decahydropyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.