Cyclohexene, 6-butyl-1-nitro-
TL;DR: Cyclohexene, 6-butyl-1-nitro- (CAS 84820-13-3) is a chemical compound with molecular formula C10H17NO2 and molecular weight 183.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butyl-1-nitrocyclohexene
Also Known As: Cyclohexene, 6-butyl-1-nitro-, 6-butyl-1-nitrocyclohexene, 6-Butyl-1-nitro-1-cyclohexene, 6-Butyl-1-nitrocyclohex-1-ene, 6-Butyl-1-nitro-1-cyclohexene #
| Molecular Formula | C10H17NO2 |
|---|---|
| Molecular Weight | 183.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.12593 |
| Heavy Atoms | 13 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 84820-13-3 |
|---|---|
| SMILES | CCCCC1CCCC=C1[N+](=O)[O-] |
| InChIKey | NFEBLOJEQRESDC-UHFFFAOYSA-N |
Product Overview
Cyclohexene, 6-butyl-1-nitro- (CAS 84820-13-3), with molecular formula C10H17NO2 and molecular weight 183.13 g/mol. IUPAC: 6-butyl-1-nitrocyclohexene.
Chemical Property Profile of Cyclohexene, 6-butyl-1-nitro-
Property Insights of Cyclohexene, 6-butyl-1-nitro-
The XLogP value of 3.6 indicates that Cyclohexene, 6-butyl-1-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, Cyclohexene, 6-butyl-1-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexene, 6-butyl-1-nitro- 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 Cyclohexene, 6-butyl-1-nitro-?
The CAS number of Cyclohexene, 6-butyl-1-nitro- is 84820-13-3.
What is the molecular formula of Cyclohexene, 6-butyl-1-nitro-?
The molecular formula of Cyclohexene, 6-butyl-1-nitro- is C10H17NO2.
What is the molecular weight of Cyclohexene, 6-butyl-1-nitro-?
The molecular weight of Cyclohexene, 6-butyl-1-nitro- is 183.13 g/mol.
Where can I buy Cyclohexene, 6-butyl-1-nitro-?
You can request a quote for Cyclohexene, 6-butyl-1-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexene, 6-butyl-1-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexene, 6-butyl-1-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.