1-Phenyl-3-tert-butyl-benzene
TL;DR: 1-Phenyl-3-tert-butyl-benzene (CAS 6635-89-8) is a chemical compound with molecular formula C16H18 and molecular weight 210.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-phenylbenzene
Also Known As: 3-t-butylbiphenyl, 3'-t-butylbiphenyl, 3-tert-butylbiphenyl, 1-tert-butyl-3-phenylbenzene, 1-phenyl-3-tert-butyl-benzene
| Molecular Formula | C16H18 |
|---|---|
| Molecular Weight | 210.14 g/mol |
| LogP | 4.6511 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.14085 |
| Heavy Atoms | 16 |
| Complexity | 460.89703 |
Chemical Identifiers
| CAS Number | 6635-89-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=CC(=C1)C2=CC=CC=C2 |
Product Overview
1-Phenyl-3-tert-butyl-benzene (CAS 6635-89-8), with molecular formula C16H18 and molecular weight 210.14 g/mol. IUPAC: 1-tert-butyl-3-phenylbenzene.
Chemical Property Profile of 1-Phenyl-3-tert-butyl-benzene
Property Insights of 1-Phenyl-3-tert-butyl-benzene
The XLogP value of 4.6511 indicates that 1-Phenyl-3-tert-butyl-benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Phenyl-3-tert-butyl-benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-tert-butyl-benzene 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-Phenyl-3-tert-butyl-benzene?
The CAS number of 1-Phenyl-3-tert-butyl-benzene is 6635-89-8.
What is the molecular formula of 1-Phenyl-3-tert-butyl-benzene?
The molecular formula of 1-Phenyl-3-tert-butyl-benzene is C16H18.
What is the molecular weight of 1-Phenyl-3-tert-butyl-benzene?
The molecular weight of 1-Phenyl-3-tert-butyl-benzene is 210.14 g/mol.
Where can I buy 1-Phenyl-3-tert-butyl-benzene?
You can request a quote for 1-Phenyl-3-tert-butyl-benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-tert-butyl-benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-tert-butyl-benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.