![1-Chloro-8-nitrocyclopenta[a]indene structure](/static/products/4187/418797-38-3.webp)
1-Chloro-8-nitrocyclopenta[a]indene
TL;DR: 1-Chloro-8-nitrocyclopenta[a]indene (CAS 418797-38-3) is a chemical compound with molecular formula C12H6ClNO2 and molecular weight 231.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-8-nitrocyclopenta[a]indene
Also Known As: 1-chloro-8-nitrocyclopenta[a]indene, 3-chloro-4-nitrocyclopenta[a]indene, BIM-0009360.P001
| Molecular Formula | C12H6ClNO2 |
|---|---|
| Molecular Weight | 231.01 g/mol |
| LogP | 1.6023 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.00871 |
| Heavy Atoms | 16 |
| Complexity | 698.21924 |
Chemical Identifiers
| CAS Number | 418797-38-3 |
|---|---|
| SMILES | C1=CC2=CC3=CC=C(C3=C2C(=C1)[N+](=O)[O-])Cl |
Product Overview
1-Chloro-8-nitrocyclopenta[a]indene (CAS 418797-38-3), with molecular formula C12H6ClNO2 and molecular weight 231.01 g/mol. IUPAC: 1-chloro-8-nitrocyclopenta[a]indene.
Chemical Property Profile of 1-Chloro-8-nitrocyclopenta[a]indene
Property Insights of 1-Chloro-8-nitrocyclopenta[a]indene
The XLogP value of 1.6023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-8-nitrocyclopenta[a]indene. With a topological polar surface area (TPSA) of 43.14 Ų, 1-Chloro-8-nitrocyclopenta[a]indene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-8-nitrocyclopenta[a]indene has 0 hydrogen bond donor(s) and 2 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-Chloro-8-nitrocyclopenta[a]indene?
The CAS number of 1-Chloro-8-nitrocyclopenta[a]indene is 418797-38-3.
What is the molecular formula of 1-Chloro-8-nitrocyclopenta[a]indene?
The molecular formula of 1-Chloro-8-nitrocyclopenta[a]indene is C12H6ClNO2.
What is the molecular weight of 1-Chloro-8-nitrocyclopenta[a]indene?
The molecular weight of 1-Chloro-8-nitrocyclopenta[a]indene is 231.01 g/mol.
Where can I buy 1-Chloro-8-nitrocyclopenta[a]indene?
You can request a quote for 1-Chloro-8-nitrocyclopenta[a]indene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-8-nitrocyclopenta[a]indene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-8-nitrocyclopenta[a]indene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.