![3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone structure](/static/products/858/858744-24-8.png)
3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone
TL;DR: 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone (CAS 858744-24-8) is a chemical compound with molecular formula C16H23NO and molecular weight 245.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2,7,7-trimethyl-3-bicyclo[4.1.0]hept-1-enyl)amino]cyclohex-2-en-1-one
Also Known As: 3-[(5,7,7-trimethyl-4-bicyclo[4.1.0]hept-5-enyl)amino]cyclohex-2-en-1-one, 3-((2,7,7-trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone, 3-[(2,7,7-trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino]cyclohex-2-en-1-one
| Molecular Formula | C16H23NO |
|---|---|
| Molecular Weight | 245.18 g/mol |
| LogP | 3.3478 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.17796 |
| Heavy Atoms | 18 |
| Complexity | 455.7174 |
Chemical Identifiers
| CAS Number | 858744-24-8 |
|---|---|
| SMILES | CC1=C2C(C2(C)C)CCC1NC3=CC(=O)CCC3 |
Product Overview
3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone (CAS 858744-24-8), with molecular formula C16H23NO and molecular weight 245.18 g/mol. IUPAC: 3-[(2,7,7-trimethyl-3-bicyclo[4.1.0]hept-1-enyl)amino]cyclohex-2-en-1-one.
Chemical Property Profile of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone
Property Insights of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone
The XLogP value of 3.3478 indicates that 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone has 1 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 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone?
The CAS number of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone is 858744-24-8.
What is the molecular formula of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone?
The molecular formula of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone is C16H23NO.
What is the molecular weight of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone?
The molecular weight of 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone is 245.18 g/mol.
Where can I buy 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone?
You can request a quote for 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone?
Yes, KEHONG BIO provides custom synthesis services for 3-((2,7,7-Trimethylbicyclo[4.1.0]hept-1-en-3-yl)amino)cyclohex-2-enone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.