2-Chloro-2-deoxyglucose
TL;DR: 2-Chloro-2-deoxyglucose (CAS 74950-97-3) is a chemical compound with molecular formula C6H11ClO5 and molecular weight 198.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4R,5R)-2-chloro-3,4,5,6-tetrahydroxyhexanal
Also Known As: 2-Chloro-2-deoxy-D-glucose, ClDG, 2-Deoxy-2-chloro-D-glucose, 2-Chloro-2-deoxyglucose, D-Glucose, 2-chloro-2-deoxy-
| Molecular Formula | C6H11ClO5 |
|---|---|
| Molecular Weight | 198.03 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 198.0295 |
| Heavy Atoms | 12 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 74950-97-3 |
|---|---|
| SMILES | C([C@H]([C@H]([C@@H]([C@H](C=O)Cl)O)O)O)O |
| InChIKey | RBEGMPAFDRYYIG-SLPGGIOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-2-deoxyglucose (CAS 74950-97-3), with molecular formula C6H11ClO5 and molecular weight 198.03 g/mol. IUPAC: (2R,3S,4R,5R)-2-chloro-3,4,5,6-tetrahydroxyhexanal.
Chemical Property Profile of 2-Chloro-2-deoxyglucose
Property Insights of 2-Chloro-2-deoxyglucose
The XLogP value of -2.2 indicates that 2-Chloro-2-deoxyglucose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-2-deoxyglucose. Following Lipinski's Rule of Five, 2-Chloro-2-deoxyglucose has 4 hydrogen bond donor(s) and 5 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 2-Chloro-2-deoxyglucose?
The CAS number of 2-Chloro-2-deoxyglucose is 74950-97-3.
What is the molecular formula of 2-Chloro-2-deoxyglucose?
The molecular formula of 2-Chloro-2-deoxyglucose is C6H11ClO5.
What is the molecular weight of 2-Chloro-2-deoxyglucose?
The molecular weight of 2-Chloro-2-deoxyglucose is 198.03 g/mol.
Where can I buy 2-Chloro-2-deoxyglucose?
You can request a quote for 2-Chloro-2-deoxyglucose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-2-deoxyglucose?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-2-deoxyglucose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.