1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-
TL;DR: 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- (CAS 5411-99-4) is a chemical compound with molecular formula C19H18Br2O2 and molecular weight 435.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dibromo-1,7-diphenylheptane-1,7-dione
Also Known As: 2,6-Dibromo-1,7-diphenyl-1,7-heptanedione, 2,6-dibromo-1,7-diphenylheptane-1,7-dione, 1, 2,6-dibromo-1,7-diphenyl-, 1,7-HEPTANEDIONE, 2,6-DIBROMO-1,7-DIPHENYL-, 2,6-Dibromo-1,7-di(phenyl)heptane-1,7-dione
| Molecular Formula | C19H18Br2O2 |
|---|---|
| Molecular Weight | 435.97 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.9653 |
| Heavy Atoms | 23 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 5411-99-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(CCCC(C(=O)C2=CC=CC=C2)Br)Br |
| InChIKey | GOIXPFUGOIGQHG-UHFFFAOYSA-N |
Product Overview
1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- (CAS 5411-99-4), with molecular formula C19H18Br2O2 and molecular weight 435.97 g/mol. IUPAC: 2,6-dibromo-1,7-diphenylheptane-1,7-dione.
Chemical Property Profile of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-
Property Insights of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-
The XLogP value of 5.7 indicates that 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-?
The CAS number of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- is 5411-99-4.
What is the molecular formula of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-?
The molecular formula of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- is C19H18Br2O2.
What is the molecular weight of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-?
The molecular weight of 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- is 435.97 g/mol.
Where can I buy 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-?
You can request a quote for 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,7-Heptanedione, 2,6-dibromo-1,7-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.