2-Chloro-4-nitrophenyl-maltopentaoside
TL;DR: 2-Chloro-4-nitrophenyl-maltopentaoside (CAS 99304-80-0) is a chemical compound with molecular formula C36H54ClNO28 and molecular weight 983.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6S)-6-(2-chloro-4-nitrophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: CNPG5, 2-Chloro-4-nitrophenyl-maltopentaoside, beta-2-Chloro-4-nitrophenyl-maltopentaoside, (2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6S)-6-(2-chloro-4-nitrophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol, (2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6S)-6-(2-chloro-4-nitrophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
| Molecular Formula | C36H54ClNO28 |
|---|---|
| Molecular Weight | 983.25 g/mol |
| LogP | -8.4 |
| Topological Polar Surface Area | 462.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 28 |
| Rotatable Bonds | 15 |
| Exact Mass | 983.2521 |
| Heavy Atoms | 66 |
| Complexity | 1530.0 |
Chemical Identifiers
| CAS Number | 99304-80-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O[C@@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O)O)O)O)O)O |
| InChIKey | KPJLHDPHGOCMDS-FCQTXGLASA-N |
Product Overview
2-Chloro-4-nitrophenyl-maltopentaoside (CAS 99304-80-0), with molecular formula C36H54ClNO28 and molecular weight 983.25 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6S)-6-(2-chloro-4-nitrophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of 2-Chloro-4-nitrophenyl-maltopentaoside
Property Insights of 2-Chloro-4-nitrophenyl-maltopentaoside
The XLogP value of -8.4 indicates that 2-Chloro-4-nitrophenyl-maltopentaoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 462.0 Ų indicates high polarity, suggesting 2-Chloro-4-nitrophenyl-maltopentaoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Chloro-4-nitrophenyl-maltopentaoside has 16 hydrogen bond donor(s) and 28 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-4-nitrophenyl-maltopentaoside?
The CAS number of 2-Chloro-4-nitrophenyl-maltopentaoside is 99304-80-0.
What is the molecular formula of 2-Chloro-4-nitrophenyl-maltopentaoside?
The molecular formula of 2-Chloro-4-nitrophenyl-maltopentaoside is C36H54ClNO28.
What is the molecular weight of 2-Chloro-4-nitrophenyl-maltopentaoside?
The molecular weight of 2-Chloro-4-nitrophenyl-maltopentaoside is 983.25 g/mol.
Where can I buy 2-Chloro-4-nitrophenyl-maltopentaoside?
You can request a quote for 2-Chloro-4-nitrophenyl-maltopentaoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-nitrophenyl-maltopentaoside?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-nitrophenyl-maltopentaoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.