3-Chloronortricyclene
TL;DR: 3-Chloronortricyclene (CAS 3509-46-4) is a chemical compound with molecular formula C7H9Cl and molecular weight 128.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chlorotricyclo[2.2.1.02,6]heptane
Also Known As: 3-Chloronortricyclene, 3-chlorotricyclo[2.2.1.02,6]heptane, 7-Chlorotricyclo[2.2.1.02,6]heptane, 3-Chlorotricyclo[2.2.1.0~2,6~]heptane, Tricyclo[2.2.1.02,6]heptane, 3-chloro-
| Molecular Formula | C7H9Cl |
|---|---|
| Molecular Weight | 128.04 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.03928 |
| Heavy Atoms | 8 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 3509-46-4 |
|---|---|
| SMILES | C1C2CC3C1C3C2Cl |
| InChIKey | BUZGNAVALTYIOX-UHFFFAOYSA-N |
Product Overview
3-Chloronortricyclene (CAS 3509-46-4), with molecular formula C7H9Cl and molecular weight 128.04 g/mol. IUPAC: 3-chlorotricyclo[2.2.1.02,6]heptane.
Chemical Property Profile of 3-Chloronortricyclene
Property Insights of 3-Chloronortricyclene
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloronortricyclene. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Chloronortricyclene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloronortricyclene has 0 hydrogen bond donor(s) and 0 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-Chloronortricyclene?
The CAS number of 3-Chloronortricyclene is 3509-46-4.
What is the molecular formula of 3-Chloronortricyclene?
The molecular formula of 3-Chloronortricyclene is C7H9Cl.
What is the molecular weight of 3-Chloronortricyclene?
The molecular weight of 3-Chloronortricyclene is 128.04 g/mol.
Where can I buy 3-Chloronortricyclene?
You can request a quote for 3-Chloronortricyclene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloronortricyclene?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloronortricyclene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.