2-Chloroethyl orthoformate
TL;DR: 2-Chloroethyl orthoformate (CAS 21840-23-3) is a chemical compound with molecular formula C23H34I3N3O11 and molecular weight 908.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypentanoyl 3,5-diacetamido-2,4,6-triiodobenzoate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
Also Known As: 2-Chloroethyl orthoformate, 2-Hydroxypentanoyl 3,5-diacetamido-2,4,6-triiodobenzoate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol, 3,5-bis(acetylamino)-2,4,6-triiodobenzoic 2-hydroxypentanoic anhydride- 1-deoxy-1-(methylamino)-d-glucitol(1:1), Benzoic acid, 3,5-diacetamido-2,4,6-triiodo-, ester with 2-hydroxyvaleric acid, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1), 2-hydroxypentanoyl 3,5-diacetamido-2,4,6-triiodobenzoate; (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
| Molecular Formula | C23H34I3N3O11 |
|---|---|
| Molecular Weight | 908.93 g/mol |
| LogP | -0.0967 |
| Topological Polar Surface Area | 235.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 14 |
| Exact Mass | 908.9328 |
| Heavy Atoms | 40 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 21840-23-3 |
|---|---|
| SMILES | CCCC(C(=O)OC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O |
| InChIKey | LXDCYHUKIVTYIC-WZTVWXICSA-N |
Product Overview
2-Chloroethyl orthoformate (CAS 21840-23-3), with molecular formula C23H34I3N3O11 and molecular weight 908.93 g/mol. IUPAC: 2-hydroxypentanoyl 3,5-diacetamido-2,4,6-triiodobenzoate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol.
Chemical Property Profile of 2-Chloroethyl orthoformate
Property Insights of 2-Chloroethyl orthoformate
The XLogP value of -0.0967 indicates that 2-Chloroethyl orthoformate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 235.0 Ų indicates high polarity, suggesting 2-Chloroethyl orthoformate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Chloroethyl orthoformate has 9 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloroethyl orthoformate?
The CAS number of 2-Chloroethyl orthoformate is 21840-23-3.
What is the molecular formula of 2-Chloroethyl orthoformate?
The molecular formula of 2-Chloroethyl orthoformate is C23H34I3N3O11.
What is the molecular weight of 2-Chloroethyl orthoformate?
The molecular weight of 2-Chloroethyl orthoformate is 908.93 g/mol.
Where can I buy 2-Chloroethyl orthoformate?
You can request a quote for 2-Chloroethyl orthoformate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl orthoformate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl orthoformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.