![2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) structure](/static/products/7499/7499-77-6.webp)
2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)
TL;DR: 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) (CAS 7499-77-6) is a chemical compound with molecular formula C29H17N3O8 and molecular weight 535.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxatetracyclo[7.6.2.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene;2,4,7-trinitrofluoren-9-one
Also Known As: 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1), 3-Oxatetracyclo[7.6.2.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene;2,4,7-trinitrofluoren-9-one
| Molecular Formula | C29H17N3O8 |
|---|---|
| Molecular Weight | 535.10 g/mol |
| LogP | 6.6458 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 535.10156 |
| Heavy Atoms | 40 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 7499-77-6 |
|---|---|
| SMILES | C1C2=CC=CC3=C2C4=C(C=CC=C4CO1)C=C3.C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=C2C(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FAIABYGELAXJCN-UHFFFAOYSA-N |
Product Overview
2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) (CAS 7499-77-6), with molecular formula C29H17N3O8 and molecular weight 535.10 g/mol. IUPAC: 3-oxatetracyclo[7.6.2.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene;2,4,7-trinitrofluoren-9-one.
Chemical Property Profile of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)
Property Insights of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)
The XLogP value of 6.6458 indicates that 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.0 Ų indicates high polarity, suggesting 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)?
The CAS number of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) is 7499-77-6.
What is the molecular formula of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)?
The molecular formula of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) is C29H17N3O8.
What is the molecular weight of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)?
The molecular weight of 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) is 535.10 g/mol.
Where can I buy 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)?
You can request a quote for 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,4,7-Trinitro-9H-fluoren-9-one--4,6-dihydrophenanthro[4,5-cde]oxepine (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.