六甲基苯
TL;DR: 六甲基苯 (CAS 87-85-4) is a chemical compound with molecular formula C12H18 and molecular weight 162.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
六甲基苯
1,2,3,4,5,6-hexamethylbenzene
Also Known As: HEXAMETHYLBENZENE, Mellitene, Benzene, hexamethyl-, Hexamethylbenzol, Hexamethyl benzene
| Molecular Formula | C12H18 |
|---|---|
| Molecular Weight | 162.14 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.14085 |
| Heavy Atoms | 12 |
| Complexity | 91.0 |
| Vapor Pressure | 0.00086 [mmHg] |
Chemical Identifiers
| CAS Number | 87-85-4 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1C)C)C)C)C |
| InChIKey | YUWFEBAXEOLKSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
六甲基苯 (CAS 87-85-4), with molecular formula C12H18 and molecular weight 162.14 g/mol. IUPAC: 1,2,3,4,5,6-hexamethylbenzene.
Chemical Property Profile of 六甲基苯
Property Insights of 六甲基苯
The XLogP value of 4.6 indicates that 六甲基苯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 六甲基苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 六甲基苯 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 六甲基苯?
The CAS number of 六甲基苯 is 87-85-4.
What is the molecular formula of 六甲基苯?
The molecular formula of 六甲基苯 is C12H18.
What is the molecular weight of 六甲基苯?
The molecular weight of 六甲基苯 is 162.14 g/mol.
Where can I buy 六甲基苯?
You can request a quote for 六甲基苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 六甲基苯?
Yes, KEHONG BIO provides custom synthesis services for 六甲基苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.