![3-Nitrodibenzo[b,f]oxepin-1-amine structure](/static/products/3613/361374-55-2.webp)
3-Nitrodibenzo[b,f]oxepin-1-amine
TL;DR: 3-Nitrodibenzo[b,f]oxepin-1-amine (CAS 361374-55-2) is a chemical compound with molecular formula C14H10N2O3 and molecular weight 254.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrobenzo[b][1]benzoxepin-4-amine
Also Known As: 3-Nitrodibenzo[b,f]oxepin-1-amine, 3-nitrodibenzo[b,f]oxepinylamine, 2-nitrobenzo[b][1]benzoxepin-4-amine, 3-Nitro-dibenzo[b,f]oxepin-1-ylamine, 3-Nitrodibenzo[b,f]oxepin-1-amine #
| Molecular Formula | C14H10N2O3 |
|---|---|
| Molecular Weight | 254.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 254.06914 |
| Heavy Atoms | 19 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 361374-55-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C(C=C(C=C3O2)[N+](=O)[O-])N |
| InChIKey | FWJXRPQKMVIYNT-UHFFFAOYSA-N |
Product Overview
3-Nitrodibenzo[b,f]oxepin-1-amine (CAS 361374-55-2), with molecular formula C14H10N2O3 and molecular weight 254.07 g/mol. IUPAC: 2-nitrobenzo[b][1]benzoxepin-4-amine.
Chemical Property Profile of 3-Nitrodibenzo[b,f]oxepin-1-amine
Property Insights of 3-Nitrodibenzo[b,f]oxepin-1-amine
The XLogP value of 3.1 indicates that 3-Nitrodibenzo[b,f]oxepin-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitrodibenzo[b,f]oxepin-1-amine. Following Lipinski's Rule of Five, 3-Nitrodibenzo[b,f]oxepin-1-amine has 1 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 3-Nitrodibenzo[b,f]oxepin-1-amine?
The CAS number of 3-Nitrodibenzo[b,f]oxepin-1-amine is 361374-55-2.
What is the molecular formula of 3-Nitrodibenzo[b,f]oxepin-1-amine?
The molecular formula of 3-Nitrodibenzo[b,f]oxepin-1-amine is C14H10N2O3.
What is the molecular weight of 3-Nitrodibenzo[b,f]oxepin-1-amine?
The molecular weight of 3-Nitrodibenzo[b,f]oxepin-1-amine is 254.07 g/mol.
Where can I buy 3-Nitrodibenzo[b,f]oxepin-1-amine?
You can request a quote for 3-Nitrodibenzo[b,f]oxepin-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitrodibenzo[b,f]oxepin-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitrodibenzo[b,f]oxepin-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.