![[3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate structure](/static/products/7083/70831-94-6.webp)
[3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate
TL;DR: [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate (CAS 70831-94-6) is a chemical compound with molecular formula C20H20BrNO9 and molecular weight 497.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate
Also Known As: [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate|Bromo 2-Deoxy-2-N-phthalimido-3,4,6-tri-O-acetyl-a,b-D-glucopyranoside|Bromo 2-Deoxy-2-N-phthalimido-3,4,6-tri-O-acetyl-I+/-,I(2)-D-glucopyranoside|(2R,3S,4R,5R)-2-(Acetoxymethyl)-6-bromo-5-(1,3-dioxoisoindolin-2-yl)tetrahydro-2H-pyran-3,4-diyl diacetate|[(2R,3S,4R,5R)-3,4-bis(acetyloxy)-6-bromo-5-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxan-2-yl]methyl acetate|[(2R,3S,4S,5R)-3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate
| Molecular Formula | C20H20BrNO9 |
|---|---|
| Molecular Weight | 497.03 g/mol |
| LogP | 1.1975 |
| Topological Polar Surface Area | 125.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 497.03214 |
| Heavy Atoms | 31 |
| Complexity | 897.9805 |
Chemical Identifiers
| CAS Number | 70831-94-6 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)Br)N2C(=O)C3=CC=CC=C3C2=O)OC(=O)C)OC(=O)C |
Product Overview
[3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate (CAS 70831-94-6), with molecular formula C20H20BrNO9 and molecular weight 497.03 g/mol. IUPAC: [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate.
Chemical Property Profile of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate
Property Insights of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate
The XLogP value of 1.1975 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate. The TPSA of 125.51 Ų falls within the moderate polarity range, balancing permeability and solubility for [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate. Following Lipinski's Rule of Five, [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate has 0 hydrogen bond donor(s) and 9 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 [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate?
The CAS number of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate is 70831-94-6.
What is the molecular formula of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate?
The molecular formula of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate is C20H20BrNO9.
What is the molecular weight of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate?
The molecular weight of [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate is 497.03 g/mol.
Where can I buy [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate?
You can request a quote for [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate?
Yes, KEHONG BIO provides custom synthesis services for [3,4-diacetyloxy-6-bromo-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.