Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-
TL;DR: Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- (CAS 69920-37-2) is a chemical compound with molecular formula C23H20O5 and molecular weight 376.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)-4-methylcyclohexan-1-one
Also Known As: 2,6-Bis(1,3-benzodioxol-5-ylmethylene)-4-methylcyclohexanone, Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-, AA-504/08907007, (2Z,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)-4-methylcyclohexan-1-one, RefChem:1082563
| Molecular Formula | C23H20O5 |
|---|---|
| Molecular Weight | 376.13 g/mol |
| LogP | 4.61 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.13107 |
| Heavy Atoms | 28 |
| Complexity | 938.1479 |
Chemical Identifiers
| CAS Number | 69920-37-2 |
|---|---|
| SMILES | CC1C/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)/C(=C\C4=CC5=C(C=C4)OCO5)/C1 |
Product Overview
Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- (CAS 69920-37-2), with molecular formula C23H20O5 and molecular weight 376.13 g/mol. IUPAC: (2Z,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)-4-methylcyclohexan-1-one.
Chemical Property Profile of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-
Property Insights of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-
The XLogP value of 4.61 indicates that Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.99 Ų, Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- has 0 hydrogen bond donor(s) and 5 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 Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-?
The CAS number of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- is 69920-37-2.
What is the molecular formula of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-?
The molecular formula of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- is C23H20O5.
What is the molecular weight of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-?
The molecular weight of Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- is 376.13 g/mol.
Where can I buy Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-?
You can request a quote for Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanone, 2,6-bis(1,3-benzodioxol-5-ylmethylene)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.