1H-Indene, 1-(1-methylethyl)-
TL;DR: 1H-Indene, 1-(1-methylethyl)- (CAS 94581-32-5) is a chemical compound with molecular formula C12H14 and molecular weight 158.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-yl-1H-indene
Also Known As: Isopropylinden, 1-isopropyl-1H-indene, 1-isopropylindene, 1H-Indene, 1-(1-methylethyl)-, 1H-Indene, (1-methylethyl)-
| Molecular Formula | C12H14 |
|---|---|
| Molecular Weight | 158.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.10954 |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 94581-32-5 |
|---|---|
| SMILES | CC(C)C1C=CC2=CC=CC=C12 |
| InChIKey | VTACPFVLSHWTGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indene, 1-(1-methylethyl)- (CAS 94581-32-5), with molecular formula C12H14 and molecular weight 158.11 g/mol. IUPAC: 1-propan-2-yl-1H-indene.
Chemical Property Profile of 1H-Indene, 1-(1-methylethyl)-
Property Insights of 1H-Indene, 1-(1-methylethyl)-
The XLogP value of 3.8 indicates that 1H-Indene, 1-(1-methylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1H-Indene, 1-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indene, 1-(1-methylethyl)- 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 1H-Indene, 1-(1-methylethyl)-?
The CAS number of 1H-Indene, 1-(1-methylethyl)- is 94581-32-5.
What is the molecular formula of 1H-Indene, 1-(1-methylethyl)-?
The molecular formula of 1H-Indene, 1-(1-methylethyl)- is C12H14.
What is the molecular weight of 1H-Indene, 1-(1-methylethyl)-?
The molecular weight of 1H-Indene, 1-(1-methylethyl)- is 158.11 g/mol.
Where can I buy 1H-Indene, 1-(1-methylethyl)-?
You can request a quote for 1H-Indene, 1-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indene, 1-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indene, 1-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.