1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-
TL;DR: 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- (CAS 69920-41-8) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(1,3-benzodioxol-5-ylmethylidene)-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-one
Also Known As: Octahydro-2-(1,3-benzodioxol-5-ylmethylene)-1(2H)-naphthalenone, 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-, (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-one, RefChem:1051401
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 3.968 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 602.481 |
Chemical Identifiers
| CAS Number | 69920-41-8 |
|---|---|
| SMILES | C1CCC2C(C1)CC/C(=C\C3=CC4=C(C=C3)OCO4)/C2=O |
Product Overview
1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- (CAS 69920-41-8), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-one.
Chemical Property Profile of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-
Property Insights of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-
The XLogP value of 3.968 indicates that 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- has 0 hydrogen bond donor(s) and 3 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 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-?
The CAS number of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- is 69920-41-8.
What is the molecular formula of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-?
The molecular formula of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- is C18H20O3.
What is the molecular weight of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-?
The molecular weight of 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- is 284.14 g/mol.
Where can I buy 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-?
You can request a quote for 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1(2H)-Naphthalenone, octahydro-2-(1,3-benzodioxol-5-ylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.