1,2-Cyclohexadiene
TL;DR: 1,2-Cyclohexadiene (CAS 14847-23-5) is a chemical compound with molecular formula C6H8 and molecular weight 80.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexa-1,2-diene
Also Known As: cyclohexa-1,2-diene, 1,2-cyclohexadiene, 4-cyclohexadiene, RefChem:1052204
| Molecular Formula | C6H8 |
|---|---|
| Molecular Weight | 80.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 80.0626 |
| Heavy Atoms | 6 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 14847-23-5 |
|---|---|
| SMILES | C1CC=C=CC1 |
| InChIKey | NMGSDTSOSIPXTN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Cyclohexadiene (CAS 14847-23-5), with molecular formula C6H8 and molecular weight 80.06 g/mol. IUPAC: cyclohexa-1,2-diene.
Chemical Property Profile of 1,2-Cyclohexadiene
Property Insights of 1,2-Cyclohexadiene
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Cyclohexadiene. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Cyclohexadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclohexadiene 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 1,2-Cyclohexadiene?
The CAS number of 1,2-Cyclohexadiene is 14847-23-5.
What is the molecular formula of 1,2-Cyclohexadiene?
The molecular formula of 1,2-Cyclohexadiene is C6H8.
What is the molecular weight of 1,2-Cyclohexadiene?
The molecular weight of 1,2-Cyclohexadiene is 80.06 g/mol.
Where can I buy 1,2-Cyclohexadiene?
You can request a quote for 1,2-Cyclohexadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclohexadiene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclohexadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.