Roundup
TL;DR: Roundup (CAS 38641-94-0) is a chemical compound with molecular formula C6H17N2O5P and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(phosphonomethylamino)acetic acid;propan-2-amine
Also Known As: Glyphosate-isopropylammonium, Utal, Nitosorg, Roundup, Rodeo
| Molecular Formula | C6H17N2O5P |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | -0.85 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.08751 |
| Heavy Atoms | 14 |
| Complexity | 173.0 |
| Melting Point | Occurs in two steps 143-164 °C and 189-223 °C |
| Solubility | In water, 1.05X10+6 mg/L at 25 °C |
| Vapor Pressure | 0.00000002 [mmHg] |
Chemical Identifiers
| CAS Number | 38641-94-0 |
|---|---|
| SMILES | CC(C)N.C(C(=O)O)NCP(=O)(O)O |
| InChIKey | ZEKANFGSDXODPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Roundup (CAS 38641-94-0), with molecular formula C6H17N2O5P and molecular weight 228.09 g/mol. IUPAC: 2-(phosphonomethylamino)acetic acid;propan-2-amine.
Chemical Property Profile of Roundup
Property Insights of Roundup
The XLogP value of -0.85 indicates that Roundup is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Roundup. Following Lipinski's Rule of Five, Roundup has 5 hydrogen bond donor(s) and 7 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 Roundup?
The CAS number of Roundup is 38641-94-0.
What is the molecular formula of Roundup?
The molecular formula of Roundup is C6H17N2O5P.
What is the molecular weight of Roundup?
The molecular weight of Roundup is 228.09 g/mol.
Where can I buy Roundup?
You can request a quote for Roundup directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Roundup?
Yes, KEHONG BIO provides custom synthesis services for Roundup and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.