![7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine structure](/static/products/328/328055-86-3.png)
7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine
TL;DR: 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine (CAS 328055-86-3) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-10-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-triene
Also Known As: 1,5-Methano-1H-3-benzazepine, 2,3,4,5-tetrahydro-7-nitro-, 4-nitro-10-aza-tricyclo[6.3.1.0*2,7*]dodeca-2,4,6-triene, 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine, 4-nitro-10-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-triene; hydrochloride
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 1.7689 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 430.59613 |
Chemical Identifiers
| CAS Number | 328055-86-3 |
|---|---|
| SMILES | C1C2CNCC1C3=C2C=CC(=C3)[N+](=O)[O-] |
Product Overview
7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine (CAS 328055-86-3), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: 4-nitro-10-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-triene.
Chemical Property Profile of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine
Property Insights of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine
The XLogP value of 1.7689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine. With a topological polar surface area (TPSA) of 55.17 Ų, 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine has 1 hydrogen bond donor(s) and 3 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 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine?
The CAS number of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine is 328055-86-3.
What is the molecular formula of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine?
The molecular formula of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine is C11H12N2O2.
What is the molecular weight of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine?
The molecular weight of 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine is 204.09 g/mol.
Where can I buy 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine?
You can request a quote for 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine?
Yes, KEHONG BIO provides custom synthesis services for 7-nitro-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.