L-酒石酸
TL;DR: L-酒石酸 (CAS 87-69-4) is a chemical compound with molecular formula C16H14N4O4S and molecular weight 358.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
L-酒石酸
2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonic acid
Also Known As: 2-((3-Methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl)benzenesulfonic acid, 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzene, 2-[(E)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl]benzenesulfonic acid, Benzenesulfonic acid,2-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-, 2-[(3-methyl-5-oxo-1-phenyl-2-pyrazolin-4-yl)diazenyl]benzenesulfonic acid
| Molecular Formula | C16H14N4O4S |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.07358 |
| Heavy Atoms | 25 |
| Complexity | 664.0 |
Chemical Identifiers
| CAS Number | 87-69-4 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=CC=CC=C2S(=O)(=O)O)C3=CC=CC=C3 |
| InChIKey | MPYKTAKYPNUACE-UHFFFAOYSA-N |
Product Overview
L-酒石酸 (CAS 87-69-4), with molecular formula C16H14N4O4S and molecular weight 358.07 g/mol. IUPAC: 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonic acid.
Chemical Property Profile of L-酒石酸
Property Insights of L-酒石酸
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-酒石酸. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for L-酒石酸. Following Lipinski's Rule of Five, L-酒石酸 has 1 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 L-酒石酸?
The CAS number of L-酒石酸 is 87-69-4.
What is the molecular formula of L-酒石酸?
The molecular formula of L-酒石酸 is C16H14N4O4S.
What is the molecular weight of L-酒石酸?
The molecular weight of L-酒石酸 is 358.07 g/mol.
Where can I buy L-酒石酸?
You can request a quote for L-酒石酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-酒石酸?
Yes, KEHONG BIO provides custom synthesis services for L-酒石酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.