5,6-Dibromo-1,1,3,3-tetramethylisoindoline
TL;DR: 5,6-Dibromo-1,1,3,3-tetramethylisoindoline (CAS 221368-76-9) is a chemical compound with molecular formula C12H15Br2N and molecular weight 330.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dibromo-1,1,3,3-tetramethyl-2H-isoindole
Also Known As: 5,6-dibromo-1,1,3,3-tetramethylisoindoline, 5,6-dibromo-1,1,3,3-tetramethyl-2H-isoindole, 56-DibroMo-1133-tetraMethylisoindoline, 1,1,3,3-Tetramethyl-5,6-dibromoisoindoline, J1.055.030K
| Molecular Formula | C12H15Br2N |
|---|---|
| Molecular Weight | 330.96 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 330.95712 |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 221368-76-9 |
|---|---|
| SMILES | CC1(C2=CC(=C(C=C2C(N1)(C)C)Br)Br)C |
| InChIKey | DHTCCDMFOWGOJW-UHFFFAOYSA-N |
Product Overview
5,6-Dibromo-1,1,3,3-tetramethylisoindoline (CAS 221368-76-9), with molecular formula C12H15Br2N and molecular weight 330.96 g/mol. IUPAC: 5,6-dibromo-1,1,3,3-tetramethyl-2H-isoindole.
Chemical Property Profile of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline
Property Insights of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline
The XLogP value of 3.4 indicates that 5,6-Dibromo-1,1,3,3-tetramethylisoindoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 5,6-Dibromo-1,1,3,3-tetramethylisoindoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dibromo-1,1,3,3-tetramethylisoindoline has 1 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 5,6-Dibromo-1,1,3,3-tetramethylisoindoline?
The CAS number of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline is 221368-76-9.
What is the molecular formula of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline?
The molecular formula of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline is C12H15Br2N.
What is the molecular weight of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline?
The molecular weight of 5,6-Dibromo-1,1,3,3-tetramethylisoindoline is 330.96 g/mol.
Where can I buy 5,6-Dibromo-1,1,3,3-tetramethylisoindoline?
You can request a quote for 5,6-Dibromo-1,1,3,3-tetramethylisoindoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dibromo-1,1,3,3-tetramethylisoindoline?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dibromo-1,1,3,3-tetramethylisoindoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.