Dimethyl 2-amino-3-oxoadipate hydrochloride
TL;DR: Dimethyl 2-amino-3-oxoadipate hydrochloride (CAS 6317-41-5) is a chemical compound with molecular formula C8H13NO5 and molecular weight 203.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-amino-3-oxohexanedioate
Also Known As: Dimethyl 2-amino-3-oxoadipate HCl, EINECS 228-656-5, Dimethyl 2-amino-3-oxoadipate hydrochloride, dimethyl 2-amino-3-oxohexanedioate, 1,6-dimethyl 2-amino-3-oxohexanedioate
| Molecular Formula | C8H13NO5 |
|---|---|
| Molecular Weight | 203.08 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 203.07938 |
| Heavy Atoms | 14 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 6317-41-5 |
|---|---|
| SMILES | COC(=O)CCC(=O)C(C(=O)OC)N |
| InChIKey | VTLRWWOCHQTVLL-UHFFFAOYSA-N |
Product Overview
Dimethyl 2-amino-3-oxoadipate hydrochloride (CAS 6317-41-5), with molecular formula C8H13NO5 and molecular weight 203.08 g/mol. IUPAC: dimethyl 2-amino-3-oxohexanedioate.
Chemical Property Profile of Dimethyl 2-amino-3-oxoadipate hydrochloride
Property Insights of Dimethyl 2-amino-3-oxoadipate hydrochloride
The XLogP value of -1.1 indicates that Dimethyl 2-amino-3-oxoadipate hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-amino-3-oxoadipate hydrochloride. Following Lipinski's Rule of Five, Dimethyl 2-amino-3-oxoadipate hydrochloride has 1 hydrogen bond donor(s) and 6 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 Dimethyl 2-amino-3-oxoadipate hydrochloride?
The CAS number of Dimethyl 2-amino-3-oxoadipate hydrochloride is 6317-41-5.
What is the molecular formula of Dimethyl 2-amino-3-oxoadipate hydrochloride?
The molecular formula of Dimethyl 2-amino-3-oxoadipate hydrochloride is C8H13NO5.
What is the molecular weight of Dimethyl 2-amino-3-oxoadipate hydrochloride?
The molecular weight of Dimethyl 2-amino-3-oxoadipate hydrochloride is 203.08 g/mol.
Where can I buy Dimethyl 2-amino-3-oxoadipate hydrochloride?
You can request a quote for Dimethyl 2-amino-3-oxoadipate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-amino-3-oxoadipate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-amino-3-oxoadipate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.