Indan, 1,1,4,5-tetramethyl-
TL;DR: Indan, 1,1,4,5-tetramethyl- (CAS 16204-57-2) is a chemical compound with molecular formula C13H18 and molecular weight 174.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,6,7-tetramethyl-1,2-dihydroindene
Also Known As: 1,1,4,5-Tetramethylindane, Indan, 1,1,4,5-tetramethyl-, 1,1,4,5-Tetramethylindan, 3,3,6,7-tetramethyl-1,2-dihydroindene, 1H-Indene, 2,3-dihydro-1,1,4,5-tetramethyl-
| Molecular Formula | C13H18 |
|---|---|
| Molecular Weight | 174.14 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.14085 |
| Heavy Atoms | 13 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 16204-57-2 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)C(CC2)(C)C)C |
| InChIKey | BKSQAMSHSDSRGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indan, 1,1,4,5-tetramethyl- (CAS 16204-57-2), with molecular formula C13H18 and molecular weight 174.14 g/mol. IUPAC: 3,3,6,7-tetramethyl-1,2-dihydroindene.
Chemical Property Profile of Indan, 1,1,4,5-tetramethyl-
Property Insights of Indan, 1,1,4,5-tetramethyl-
The XLogP value of 4.4 indicates that Indan, 1,1,4,5-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Indan, 1,1,4,5-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indan, 1,1,4,5-tetramethyl- 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 Indan, 1,1,4,5-tetramethyl-?
The CAS number of Indan, 1,1,4,5-tetramethyl- is 16204-57-2.
What is the molecular formula of Indan, 1,1,4,5-tetramethyl-?
The molecular formula of Indan, 1,1,4,5-tetramethyl- is C13H18.
What is the molecular weight of Indan, 1,1,4,5-tetramethyl-?
The molecular weight of Indan, 1,1,4,5-tetramethyl- is 174.14 g/mol.
Where can I buy Indan, 1,1,4,5-tetramethyl-?
You can request a quote for Indan, 1,1,4,5-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indan, 1,1,4,5-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for Indan, 1,1,4,5-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.