(tert-Butyl)dimethylnaphthalene
TL;DR: (tert-Butyl)dimethylnaphthalene (CAS 85650-81-3) is a chemical compound with molecular formula C16H20 and molecular weight 212.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-1,2-dimethylnaphthalene
Also Known As: (tert-Butyl)dimethylnaphthalene, DIMETHYLNAPHTHALENE, 3-tert-butyl-1,2-dimethylnaphthalene, EINECS 288-091-5, C16-H20
| Molecular Formula | C16H20 |
|---|---|
| Molecular Weight | 212.16 g/mol |
| LogP | 4.75414 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.1565 |
| Heavy Atoms | 16 |
| Complexity | 527.46497 |
Chemical Identifiers
| CAS Number | 85650-81-3 |
|---|---|
| SMILES | CC1=C(C(=CC2=CC=CC=C12)C(C)(C)C)C |
Product Overview
(tert-Butyl)dimethylnaphthalene (CAS 85650-81-3), with molecular formula C16H20 and molecular weight 212.16 g/mol. IUPAC: 3-tert-butyl-1,2-dimethylnaphthalene.
Chemical Property Profile of (tert-Butyl)dimethylnaphthalene
Property Insights of (tert-Butyl)dimethylnaphthalene
The XLogP value of 4.75414 indicates that (tert-Butyl)dimethylnaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (tert-Butyl)dimethylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (tert-Butyl)dimethylnaphthalene 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 (tert-Butyl)dimethylnaphthalene?
The CAS number of (tert-Butyl)dimethylnaphthalene is 85650-81-3.
What is the molecular formula of (tert-Butyl)dimethylnaphthalene?
The molecular formula of (tert-Butyl)dimethylnaphthalene is C16H20.
What is the molecular weight of (tert-Butyl)dimethylnaphthalene?
The molecular weight of (tert-Butyl)dimethylnaphthalene is 212.16 g/mol.
Where can I buy (tert-Butyl)dimethylnaphthalene?
You can request a quote for (tert-Butyl)dimethylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (tert-Butyl)dimethylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for (tert-Butyl)dimethylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.