Hexahydrohippurate
TL;DR: Hexahydrohippurate (CAS 32377-88-1) is a chemical compound with molecular formula C9H15NO3 and molecular weight 185.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(cyclohexanecarbonylamino)acetic acid
Also Known As: Hexahydrohippurate, hexahydrohippuric acid, Cyclohexanoylglycine, (Cyclohexanecarbonyl)glycine, (Cyclohexanecarbonyl-amino)-acetic acid
| Molecular Formula | C9H15NO3 |
|---|---|
| Molecular Weight | 185.11 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.1052 |
| Heavy Atoms | 13 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 32377-88-1 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)NCC(=O)O |
| InChIKey | ROXXNENGCGLRSW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexahydrohippurate (CAS 32377-88-1), with molecular formula C9H15NO3 and molecular weight 185.11 g/mol. IUPAC: 2-(cyclohexanecarbonylamino)acetic acid.
Chemical Property Profile of Hexahydrohippurate
Property Insights of Hexahydrohippurate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydrohippurate. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexahydrohippurate. Following Lipinski's Rule of Five, Hexahydrohippurate has 2 hydrogen bond donor(s) and 3 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 Hexahydrohippurate?
The CAS number of Hexahydrohippurate is 32377-88-1.
What is the molecular formula of Hexahydrohippurate?
The molecular formula of Hexahydrohippurate is C9H15NO3.
What is the molecular weight of Hexahydrohippurate?
The molecular weight of Hexahydrohippurate is 185.11 g/mol.
Where can I buy Hexahydrohippurate?
You can request a quote for Hexahydrohippurate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydrohippurate?
Yes, KEHONG BIO provides custom synthesis services for Hexahydrohippurate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.