6-Fluoromevalonate-5-pyrophosphate
TL;DR: 6-Fluoromevalonate-5-pyrophosphate (CAS 3474-04-2) is a chemical compound with molecular formula C6H13FO10P2 and molecular weight 326.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(fluoromethyl)-3-hydroxy-5-[hydroxy(phosphonooxy)phosphoryl]oxypentanoic acid
Also Known As: 6-Fmvapp, 6-Fluoromevalonate-5-pyrophosphate, 3-Hydroxy-3-(fluoromethyl)-5-pyrophosphopentanoic acid, 3-(fluoromethyl)-3-hydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}pentanoic acid, 7-(Fluoromethyl)-1,1,3,7-tetrahydroxy-2,4-dioxa-1,3-diphosphanonan-9-oic acid 1,3-dioxide
| Molecular Formula | C6H13FO10P2 |
|---|---|
| Molecular Weight | 326.00 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 325.9968 |
| Heavy Atoms | 19 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 3474-04-2 |
|---|---|
| SMILES | C(COP(=O)(O)OP(=O)(O)O)C(CC(=O)O)(CF)O |
| InChIKey | YIGLDWRZXXHIGZ-UHFFFAOYSA-N |
Product Overview
6-Fluoromevalonate-5-pyrophosphate (CAS 3474-04-2), with molecular formula C6H13FO10P2 and molecular weight 326.00 g/mol. IUPAC: 3-(fluoromethyl)-3-hydroxy-5-[hydroxy(phosphonooxy)phosphoryl]oxypentanoic acid.
Chemical Property Profile of 6-Fluoromevalonate-5-pyrophosphate
Property Insights of 6-Fluoromevalonate-5-pyrophosphate
The XLogP value of -3.2 indicates that 6-Fluoromevalonate-5-pyrophosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 171.0 Ų indicates high polarity, suggesting 6-Fluoromevalonate-5-pyrophosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Fluoromevalonate-5-pyrophosphate has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Fluoromevalonate-5-pyrophosphate?
The CAS number of 6-Fluoromevalonate-5-pyrophosphate is 3474-04-2.
What is the molecular formula of 6-Fluoromevalonate-5-pyrophosphate?
The molecular formula of 6-Fluoromevalonate-5-pyrophosphate is C6H13FO10P2.
What is the molecular weight of 6-Fluoromevalonate-5-pyrophosphate?
The molecular weight of 6-Fluoromevalonate-5-pyrophosphate is 326.00 g/mol.
Where can I buy 6-Fluoromevalonate-5-pyrophosphate?
You can request a quote for 6-Fluoromevalonate-5-pyrophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Fluoromevalonate-5-pyrophosphate?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoromevalonate-5-pyrophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.