Laetrile
TL;DR: Laetrile (CAS 1332-94-1) is a chemical compound with molecular formula C14H15NO7 and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-6-[(S)-cyano(phenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Laetrile
| Molecular Formula | C14H15NO7 |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.08484 |
| Heavy Atoms | 22 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 1332-94-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)[C@@H](C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
| InChIKey | XLSLFPQAPYONPW-CBIHJVFNSA-N |
Product Overview
Laetrile (CAS 1332-94-1), with molecular formula C14H15NO7 and molecular weight 309.08 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[(S)-cyano(phenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of Laetrile
Property Insights of Laetrile
The XLogP value of -0.3 indicates that Laetrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting Laetrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Laetrile has 4 hydrogen bond donor(s) and 8 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 Laetrile?
The CAS number of Laetrile is 1332-94-1.
What is the molecular formula of Laetrile?
The molecular formula of Laetrile is C14H15NO7.
What is the molecular weight of Laetrile?
The molecular weight of Laetrile is 309.08 g/mol.
Where can I buy Laetrile?
You can request a quote for Laetrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Laetrile?
Yes, KEHONG BIO provides custom synthesis services for Laetrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.