2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-
TL;DR: 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- (CAS 72765-99-2) is a chemical compound with molecular formula C11H9ClO4 and molecular weight 240.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-chloro-4-oxo-2,3-dihydrochromen-6-yl)acetic acid
Also Known As: 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-, 3,4-Dihydro-7-chloro-4-oxo-2H-1-benzopyran-6-acetic acid, 2-(7-chloro-4-oxo-2,3-dihydrochromen-6-yl)acetic acid, (7-Chloro-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)acetic acid, RefChem:268350
| Molecular Formula | C11H9ClO4 |
|---|---|
| Molecular Weight | 240.02 g/mol |
| LogP | 1.9323 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.01894 |
| Heavy Atoms | 16 |
| Complexity | 467.29752 |
Chemical Identifiers
| CAS Number | 72765-99-2 |
|---|---|
| SMILES | C1COC2=C(C1=O)C=C(C(=C2)Cl)CC(=O)O |
Product Overview
2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- (CAS 72765-99-2), with molecular formula C11H9ClO4 and molecular weight 240.02 g/mol. IUPAC: 2-(7-chloro-4-oxo-2,3-dihydrochromen-6-yl)acetic acid.
Chemical Property Profile of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-
Property Insights of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-
The XLogP value of 1.9323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-. Following Lipinski's Rule of Five, 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- 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 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-?
The CAS number of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- is 72765-99-2.
What is the molecular formula of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-?
The molecular formula of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- is C11H9ClO4.
What is the molecular weight of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-?
The molecular weight of 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- is 240.02 g/mol.
Where can I buy 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-?
You can request a quote for 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-6-acetic acid, 3,4-dihydro-7-chloro-4-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.