Mandelic acid, calcium salt (2:1), L-(+)-
TL;DR: Mandelic acid, calcium salt (2:1), L-(+)- (CAS 19944-53-7) is a chemical compound with molecular formula C16H14CaO6 and molecular weight 342.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;2-hydroxy-2-phenylacetate;(2S)-2-hydroxy-2-phenylacetate
Also Known As: Calcium dimandelate, L-(+)-Mandelic acid calcium salt, MANDELIC ACID, CALCIUM SALT (2:1), L-(+)-, calcium;2-hydroxy-2-phenylacetate;(2S)-2-hydroxy-2-phenylacetate, calcium; 2-hydroxy-2-phenylacetate; (2S)-2-hydroxy-2-phenylacetate
| Molecular Formula | C16H14CaO6 |
|---|---|
| Molecular Weight | 342.04 g/mol |
| LogP | -1.44 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.04163 |
| Heavy Atoms | 23 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 19944-53-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)[C@@H](C(=O)[O-])O.C1=CC=C(C=C1)C(C(=O)[O-])O.[Ca+2] |
| InChIKey | GCXSYHGQGJCRRW-KLXURFKVSA-L |
Product Overview
Mandelic acid, calcium salt (2:1), L-(+)- (CAS 19944-53-7), with molecular formula C16H14CaO6 and molecular weight 342.04 g/mol. IUPAC: calcium;2-hydroxy-2-phenylacetate;(2S)-2-hydroxy-2-phenylacetate.
Chemical Property Profile of Mandelic acid, calcium salt (2:1), L-(+)-
Property Insights of Mandelic acid, calcium salt (2:1), L-(+)-
The XLogP value of -1.44 indicates that Mandelic acid, calcium salt (2:1), L-(+)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mandelic acid, calcium salt (2:1), L-(+)-. Following Lipinski's Rule of Five, Mandelic acid, calcium salt (2:1), L-(+)- has 2 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 Mandelic acid, calcium salt (2:1), L-(+)-?
The CAS number of Mandelic acid, calcium salt (2:1), L-(+)- is 19944-53-7.
What is the molecular formula of Mandelic acid, calcium salt (2:1), L-(+)-?
The molecular formula of Mandelic acid, calcium salt (2:1), L-(+)- is C16H14CaO6.
What is the molecular weight of Mandelic acid, calcium salt (2:1), L-(+)-?
The molecular weight of Mandelic acid, calcium salt (2:1), L-(+)- is 342.04 g/mol.
Where can I buy Mandelic acid, calcium salt (2:1), L-(+)-?
You can request a quote for Mandelic acid, calcium salt (2:1), L-(+)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mandelic acid, calcium salt (2:1), L-(+)-?
Yes, KEHONG BIO provides custom synthesis services for Mandelic acid, calcium salt (2:1), L-(+)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.