4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene
TL;DR: 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene (CAS 54889-53-1) is a chemical compound with molecular formula C15H22 and molecular weight 202.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-butyl-3,3-dimethyl-1,2-dihydroindene
Also Known As: 4-Butyl-1,1-dimethylindane, 4-Butyl-1,1-dimethylindane #, 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene, 7-butyl-3,3-dimethyl-1,2-dihydroindene, 1H-Indene, 4-butyl-2,3-dihydro-1,1-dimethyl-
| Molecular Formula | C15H22 |
|---|---|
| Molecular Weight | 202.17 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.17215 |
| Heavy Atoms | 15 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 54889-53-1 |
|---|---|
| SMILES | CCCCC1=C2CCC(C2=CC=C1)(C)C |
| InChIKey | XZCJMHUBNFBWNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene (CAS 54889-53-1), with molecular formula C15H22 and molecular weight 202.17 g/mol. IUPAC: 7-butyl-3,3-dimethyl-1,2-dihydroindene.
Chemical Property Profile of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene
Property Insights of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene
The XLogP value of 5.5 indicates that 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene?
The CAS number of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene is 54889-53-1.
What is the molecular formula of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene?
The molecular formula of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene is C15H22.
What is the molecular weight of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene?
The molecular weight of 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene is 202.17 g/mol.
Where can I buy 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene?
You can request a quote for 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene?
Yes, KEHONG BIO provides custom synthesis services for 4-Butyl-2,3-dihydro-1,1-dimethyl-1H-indene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.