2-Methylnaphthalene-1,4-diyl dibenzoate
TL;DR: 2-Methylnaphthalene-1,4-diyl dibenzoate (CAS 2211-31-6) is a chemical compound with molecular formula C25H18O4 and molecular weight 382.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzoyloxy-3-methylnaphthalen-1-yl) benzoate
Also Known As: 2-Methylnaphthalene-1,4-diyl dibenzoate, 2-methylnaphthalene-1,4-diyldibenzoate, 1,4-dibenzoyloxy-2-methyl naphthalene, 1,4-DIBENZOYLOXY-2-METHYLNAPHTHALENE, 1,4-Naphthalenediol,2-methyl-, 1,4-dibenzoate
| Molecular Formula | C25H18O4 |
|---|---|
| Molecular Weight | 382.12 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.1205 |
| Heavy Atoms | 29 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 2211-31-6 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2C(=C1)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
| InChIKey | BVVDINJVWBJRHY-UHFFFAOYSA-N |
Product Overview
2-Methylnaphthalene-1,4-diyl dibenzoate (CAS 2211-31-6), with molecular formula C25H18O4 and molecular weight 382.12 g/mol. IUPAC: (4-benzoyloxy-3-methylnaphthalen-1-yl) benzoate.
Chemical Property Profile of 2-Methylnaphthalene-1,4-diyl dibenzoate
Property Insights of 2-Methylnaphthalene-1,4-diyl dibenzoate
The XLogP value of 6.4 indicates that 2-Methylnaphthalene-1,4-diyl dibenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Methylnaphthalene-1,4-diyl dibenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylnaphthalene-1,4-diyl dibenzoate 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 2-Methylnaphthalene-1,4-diyl dibenzoate?
The CAS number of 2-Methylnaphthalene-1,4-diyl dibenzoate is 2211-31-6.
What is the molecular formula of 2-Methylnaphthalene-1,4-diyl dibenzoate?
The molecular formula of 2-Methylnaphthalene-1,4-diyl dibenzoate is C25H18O4.
What is the molecular weight of 2-Methylnaphthalene-1,4-diyl dibenzoate?
The molecular weight of 2-Methylnaphthalene-1,4-diyl dibenzoate is 382.12 g/mol.
Where can I buy 2-Methylnaphthalene-1,4-diyl dibenzoate?
You can request a quote for 2-Methylnaphthalene-1,4-diyl dibenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylnaphthalene-1,4-diyl dibenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylnaphthalene-1,4-diyl dibenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.