5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene
TL;DR: 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene (CAS 51522-30-6) is a chemical compound with molecular formula C10H10N2O4 and molecular weight 222.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dinitro-1,2,3,4-tetrahydronaphthalene
Also Known As: 5,7-dinitro-1,2,3,4-tetrahydronaphthalene, 5,7-dinitrotetralin, 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene, AE-562/12222981, 1,3-DINITRO-5,6,7,8-TETRAHYDRONAPHTHALENE
| Molecular Formula | C10H10N2O4 |
|---|---|
| Molecular Weight | 222.06 g/mol |
| LogP | 2.3818 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.06406 |
| Heavy Atoms | 16 |
| Complexity | 470.132 |
Chemical Identifiers
| CAS Number | 51522-30-6 |
|---|---|
| SMILES | C1CCC2=C(C1)C=C(C=C2[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene (CAS 51522-30-6), with molecular formula C10H10N2O4 and molecular weight 222.06 g/mol. IUPAC: 5,7-dinitro-1,2,3,4-tetrahydronaphthalene.
Chemical Property Profile of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene
Property Insights of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene
The XLogP value of 2.3818 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene. Following Lipinski's Rule of Five, 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene has 0 hydrogen bond donor(s) and 4 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 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene?
The CAS number of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene is 51522-30-6.
What is the molecular formula of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene?
The molecular formula of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene is C10H10N2O4.
What is the molecular weight of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene?
The molecular weight of 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene is 222.06 g/mol.
Where can I buy 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene?
You can request a quote for 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dinitro-1,2,3,4-tetrahydro-naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.