2,2-Dibromo-1-indanone
TL;DR: 2,2-Dibromo-1-indanone (CAS 8058-05-7) is a chemical compound with molecular formula C9H6Br2O and molecular weight 287.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dibromo-3H-inden-1-one
Also Known As: 2,2-Dibromo-1-indanone, 2,2-dibromoindan-1-one, 2,2-dibromo-3H-inden-1-one, 2,2-dibromo-2,3-dihydro-1H-inden-1-one, 2,2-Dibromo-1-indanone #
| Molecular Formula | C9H6Br2O |
|---|---|
| Molecular Weight | 287.88 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.87854 |
| Heavy Atoms | 12 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 8058-05-7 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)C1(Br)Br |
| InChIKey | VGEJBODXYMOIGZ-UHFFFAOYSA-N |
Product Overview
2,2-Dibromo-1-indanone (CAS 8058-05-7), with molecular formula C9H6Br2O and molecular weight 287.88 g/mol. IUPAC: 2,2-dibromo-3H-inden-1-one.
Chemical Property Profile of 2,2-Dibromo-1-indanone
Property Insights of 2,2-Dibromo-1-indanone
The XLogP value of 3.2 indicates that 2,2-Dibromo-1-indanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,2-Dibromo-1-indanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dibromo-1-indanone has 0 hydrogen bond donor(s) and 1 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 2,2-Dibromo-1-indanone?
The CAS number of 2,2-Dibromo-1-indanone is 8058-05-7.
What is the molecular formula of 2,2-Dibromo-1-indanone?
The molecular formula of 2,2-Dibromo-1-indanone is C9H6Br2O.
What is the molecular weight of 2,2-Dibromo-1-indanone?
The molecular weight of 2,2-Dibromo-1-indanone is 287.88 g/mol.
Where can I buy 2,2-Dibromo-1-indanone?
You can request a quote for 2,2-Dibromo-1-indanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dibromo-1-indanone?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dibromo-1-indanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.