2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)
TL;DR: 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) (CAS 313507-26-5) is a chemical compound with molecular formula C19H19Br2N3O6 and molecular weight 542.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-[6-(5-bromo-2-hydroxyphenyl)-4,4-dimethyl-3,5-dinitropiperidin-2-yl]phenol
Also Known As: BAS 02226497, 2,2'-(4,4-dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol), AJ-292/12443014, 4-bromo-2-{6-(5-bromo-2-hydroxyphenyl)-3,5-dinitro-4,4-dimethyl-2-piperidinyl}phenol, 4-bromo-2-[6-(5-bromo-2-hydroxyphenyl)-4,4-dimethyl-3,5-dinitropiperidin-2-yl]phenol
| Molecular Formula | C19H19Br2N3O6 |
|---|---|
| Molecular Weight | 542.96 g/mol |
| LogP | 4.3252 |
| Topological Polar Surface Area | 138.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 542.96405 |
| Heavy Atoms | 30 |
| Complexity | 938.2594 |
Chemical Identifiers
| CAS Number | 313507-26-5 |
|---|---|
| SMILES | CC1(C(C(NC(C1[N+](=O)[O-])C2=C(C=CC(=C2)Br)O)C3=C(C=CC(=C3)Br)O)[N+](=O)[O-])C |
Product Overview
2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) (CAS 313507-26-5), with molecular formula C19H19Br2N3O6 and molecular weight 542.96 g/mol. IUPAC: 4-bromo-2-[6-(5-bromo-2-hydroxyphenyl)-4,4-dimethyl-3,5-dinitropiperidin-2-yl]phenol.
Chemical Property Profile of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)
Property Insights of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)
The XLogP value of 4.3252 indicates that 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol). Following Lipinski's Rule of Five, 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)?
The CAS number of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) is 313507-26-5.
What is the molecular formula of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)?
The molecular formula of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) is C19H19Br2N3O6.
What is the molecular weight of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)?
The molecular weight of 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) is 542.96 g/mol.
Where can I buy 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)?
You can request a quote for 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-(4,4-Dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(4-bromophenol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.