1,7-dimethoxy naphthalene
TL;DR: 1,7-dimethoxy naphthalene (CAS 57221-80-4) is a chemical compound with molecular formula C21H32O5 and molecular weight 364.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 16-(2-hydroxypropan-2-yl)-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5-carboxylate
Also Known As: 1,7-dimethoxy naphthalene, 2H-2,4a-Ethenonaphtho[2,1-c][1,2]dioxin-7-carboxylic acid, 1,5,6,6a,7,8,9,10,10a,10b-decahydro-12-(1-hydroxy-1-methylethyl)-7,10a-dimethyl-, methyl ester, n'-methyl-n,n-di(propan-2-yl)benzene-1,4-dicarboxamide, methyl (1-hydroxy-1-methyl-ethyl)-dimethyl-[?]carboxylate, Methyl 2-(2-hydroxypropan-2-yl)-4b,8-dimethyl-4,4a,4b,5,6,7,8,8a,9,10-decahydro-3H-3,10a-epidioxyphenanthrene-8-carboxylate
| Molecular Formula | C21H32O5 |
|---|---|
| Molecular Weight | 364.22 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.22498 |
| Heavy Atoms | 26 |
| Complexity | 655.0 |
Chemical Identifiers
| CAS Number | 57221-80-4 |
|---|---|
| SMILES | CC12CCCC(C1CCC34C2CC(C(=C3)C(C)(C)O)OO4)(C)C(=O)OC |
| InChIKey | IOWHRFKVRZOMCP-UHFFFAOYSA-N |
Product Overview
1,7-dimethoxy naphthalene (CAS 57221-80-4), with molecular formula C21H32O5 and molecular weight 364.22 g/mol. IUPAC: methyl 16-(2-hydroxypropan-2-yl)-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5-carboxylate.
Chemical Property Profile of 1,7-dimethoxy naphthalene
Property Insights of 1,7-dimethoxy naphthalene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7-dimethoxy naphthalene. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,7-dimethoxy naphthalene. Following Lipinski's Rule of Five, 1,7-dimethoxy naphthalene has 1 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 1,7-dimethoxy naphthalene?
The CAS number of 1,7-dimethoxy naphthalene is 57221-80-4.
What is the molecular formula of 1,7-dimethoxy naphthalene?
The molecular formula of 1,7-dimethoxy naphthalene is C21H32O5.
What is the molecular weight of 1,7-dimethoxy naphthalene?
The molecular weight of 1,7-dimethoxy naphthalene is 364.22 g/mol.
Where can I buy 1,7-dimethoxy naphthalene?
You can request a quote for 1,7-dimethoxy naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7-dimethoxy naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1,7-dimethoxy naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.