(4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate
TL;DR: (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate (CAS 57998-97-7) is a chemical compound with molecular formula C26H22O4 and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate
Also Known As: (4-benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate, 6,7-Dimethyl-5,8-dihydronaphthalene-1,4-diyl dibenzoate, (4-benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzo
| Molecular Formula | C26H22O4 |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1518 |
| Heavy Atoms | 30 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 57998-97-7 |
|---|---|
| SMILES | CC1=C(CC2=C(C=CC(=C2C1)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C |
| InChIKey | AYFJYLHAAJWVCL-UHFFFAOYSA-N |
Product Overview
(4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate (CAS 57998-97-7), with molecular formula C26H22O4 and molecular weight 398.15 g/mol. IUPAC: (4-benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate.
Chemical Property Profile of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate
Property Insights of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate
The XLogP value of 5.7 indicates that (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate?
The CAS number of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate is 57998-97-7.
What is the molecular formula of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate?
The molecular formula of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate is C26H22O4.
What is the molecular weight of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate?
The molecular weight of (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate is 398.15 g/mol.
Where can I buy (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate?
You can request a quote for (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Benzoyloxy-6,7-dimethyl-5,8-dihydronaphthalen-1-yl) benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.