2,5-Dichloro-2,5-dimethyl-3-hexene
TL;DR: 2,5-Dichloro-2,5-dimethyl-3-hexene (CAS 78162-10-4) is a chemical compound with molecular formula C8H14Cl2 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-2,5-dimethylhex-3-ene
Also Known As: 2,5-dichloro-2,5-dimethyl-3-hexene, 2,5-dichloro-2,5-dimethylhex-3-ene, trans-2,5-Dichloror-2,5-dimethyl-3-hexene, (E)-2, 5-Dichloro-2, 5-dimethyl-hex-3-ene
| Molecular Formula | C8H14Cl2 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.04726 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 78162-10-4 |
|---|---|
| SMILES | CC(C)(C=CC(C)(C)Cl)Cl |
| InChIKey | ANSLDRRWTXDPKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dichloro-2,5-dimethyl-3-hexene (CAS 78162-10-4), with molecular formula C8H14Cl2 and molecular weight 180.05 g/mol. IUPAC: 2,5-dichloro-2,5-dimethylhex-3-ene.
Chemical Property Profile of 2,5-Dichloro-2,5-dimethyl-3-hexene
Property Insights of 2,5-Dichloro-2,5-dimethyl-3-hexene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dichloro-2,5-dimethyl-3-hexene. With a topological polar surface area (TPSA) of 0.0 Ų, 2,5-Dichloro-2,5-dimethyl-3-hexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dichloro-2,5-dimethyl-3-hexene 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 2,5-Dichloro-2,5-dimethyl-3-hexene?
The CAS number of 2,5-Dichloro-2,5-dimethyl-3-hexene is 78162-10-4.
What is the molecular formula of 2,5-Dichloro-2,5-dimethyl-3-hexene?
The molecular formula of 2,5-Dichloro-2,5-dimethyl-3-hexene is C8H14Cl2.
What is the molecular weight of 2,5-Dichloro-2,5-dimethyl-3-hexene?
The molecular weight of 2,5-Dichloro-2,5-dimethyl-3-hexene is 180.05 g/mol.
Where can I buy 2,5-Dichloro-2,5-dimethyl-3-hexene?
You can request a quote for 2,5-Dichloro-2,5-dimethyl-3-hexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichloro-2,5-dimethyl-3-hexene?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichloro-2,5-dimethyl-3-hexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.