![3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- structure](/static/products/1119/111982-23-1.webp)
3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-
TL;DR: 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- (CAS 111982-23-1) is a chemical compound with molecular formula C20H31BrO7 and molecular weight 462.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
27-bromo-3,6,9,12,15,18,21-heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene
Also Known As: 27-Bromo-3,6,9,12,15,18,21-heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-Bromo-3,6,9,12,15,18,21-heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene #, 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-
| Molecular Formula | C20H31BrO7 |
|---|---|
| Molecular Weight | 462.13 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 462.1253 |
| Heavy Atoms | 28 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 111982-23-1 |
|---|---|
| SMILES | C1COCCOCCOCC2=C(C(=CC=C2)COCCOCCOCCO1)Br |
| InChIKey | XDWHDHNSJKZKNY-UHFFFAOYSA-N |
Product Overview
3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- (CAS 111982-23-1), with molecular formula C20H31BrO7 and molecular weight 462.13 g/mol. IUPAC: 27-bromo-3,6,9,12,15,18,21-heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene.
Chemical Property Profile of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-
Property Insights of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-. Following Lipinski's Rule of Five, 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- has 0 hydrogen bond donor(s) and 7 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 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-?
The CAS number of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- is 111982-23-1.
What is the molecular formula of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-?
The molecular formula of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- is C20H31BrO7.
What is the molecular weight of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-?
The molecular weight of 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- is 462.13 g/mol.
Where can I buy 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-?
You can request a quote for 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo-?
Yes, KEHONG BIO provides custom synthesis services for 3,6,9,12,15,18,21-Heptaoxabicyclo[21.3.1]heptacosa-1(27),23,25-triene, 27-bromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.