Cyclopenta(cd)pyrene, 4-nitro-
TL;DR: Cyclopenta(cd)pyrene, 4-nitro- (CAS 102859-52-9) is a chemical compound with molecular formula C18H9NO2 and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitropentacyclo[12.3.1.04,17.07,16.010,15]octadeca-1(18),2,4(17),5,7(16),8,10(15),11,13-nonaene
Also Known As: Cyclopenta(cd)pyrene, 4-nitro-, 4-Nitrocyclopenta(cd)pyrene, 4-Nitrocyclopenta[cd]pyrene, 4-Nitrocyclopenta(c,d)pyrene, NIOSH/GY5864000
| Molecular Formula | C18H9NO2 |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 271.06332 |
| Heavy Atoms | 21 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 102859-52-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=C4C(=CC5=C4C3=C(C=C2)C=C5)[N+](=O)[O-] |
| InChIKey | SQAFYTHBQZQFLZ-UHFFFAOYSA-N |
Product Overview
Cyclopenta(cd)pyrene, 4-nitro- (CAS 102859-52-9), with molecular formula C18H9NO2 and molecular weight 271.06 g/mol. IUPAC: 2-nitropentacyclo[12.3.1.04,17.07,16.010,15]octadeca-1(18),2,4(17),5,7(16),8,10(15),11,13-nonaene.
Chemical Property Profile of Cyclopenta(cd)pyrene, 4-nitro-
Property Insights of Cyclopenta(cd)pyrene, 4-nitro-
The XLogP value of 5.1 indicates that Cyclopenta(cd)pyrene, 4-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Cyclopenta(cd)pyrene, 4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopenta(cd)pyrene, 4-nitro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclopenta(cd)pyrene, 4-nitro-?
The CAS number of Cyclopenta(cd)pyrene, 4-nitro- is 102859-52-9.
What is the molecular formula of Cyclopenta(cd)pyrene, 4-nitro-?
The molecular formula of Cyclopenta(cd)pyrene, 4-nitro- is C18H9NO2.
What is the molecular weight of Cyclopenta(cd)pyrene, 4-nitro-?
The molecular weight of Cyclopenta(cd)pyrene, 4-nitro- is 271.06 g/mol.
Where can I buy Cyclopenta(cd)pyrene, 4-nitro-?
You can request a quote for Cyclopenta(cd)pyrene, 4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopenta(cd)pyrene, 4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Cyclopenta(cd)pyrene, 4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.