6-chloro-2H-chromene-3-carboxylic acid
TL;DR: 6-chloro-2H-chromene-3-carboxylic acid (CAS 83823-06-7) is a chemical compound with molecular formula C10H7ClO3 and molecular weight 210.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2H-chromene-3-carboxylic acid
Also Known As: 6-Chloro-2H-chromene-3-carboxylic acid, 6-Chloro-2H-1-benzopyran-3-carboxylic acid, Maybridge1_005975, chlorochromenecarboxylicacid, 2H-1-Benzopyran-3-carboxylicacid, 6-chloro-
| Molecular Formula | C10H7ClO3 |
|---|---|
| Molecular Weight | 210.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.00838 |
| Heavy Atoms | 14 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 83823-06-7 |
|---|---|
| SMILES | C1C(=CC2=C(O1)C=CC(=C2)Cl)C(=O)O |
| InChIKey | ZRCGKWSNRRTAJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-chloro-2H-chromene-3-carboxylic acid (CAS 83823-06-7), with molecular formula C10H7ClO3 and molecular weight 210.01 g/mol. IUPAC: 6-chloro-2H-chromene-3-carboxylic acid.
Chemical Property Profile of 6-chloro-2H-chromene-3-carboxylic acid
Property Insights of 6-chloro-2H-chromene-3-carboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-2H-chromene-3-carboxylic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 6-chloro-2H-chromene-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-2H-chromene-3-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 6-chloro-2H-chromene-3-carboxylic acid?
The CAS number of 6-chloro-2H-chromene-3-carboxylic acid is 83823-06-7.
What is the molecular formula of 6-chloro-2H-chromene-3-carboxylic acid?
The molecular formula of 6-chloro-2H-chromene-3-carboxylic acid is C10H7ClO3.
What is the molecular weight of 6-chloro-2H-chromene-3-carboxylic acid?
The molecular weight of 6-chloro-2H-chromene-3-carboxylic acid is 210.01 g/mol.
Where can I buy 6-chloro-2H-chromene-3-carboxylic acid?
You can request a quote for 6-chloro-2H-chromene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-2H-chromene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-2H-chromene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.