6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-
TL;DR: 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- (CAS 62000-46-8) is a chemical compound with molecular formula C12H11ClO2 and molecular weight 222.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-6,6-dimethylisochromene-4-carbaldehyde
Also Known As: 8-chloro-6,6-dimethylisochromene-4-carbaldehyde, 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-, 8-chloro-6,6-dimethyl-isochromene-4-carbaldehyde, 6H-2-Benzopyran-4-carboxaldehyde,8-chloro-6,6-dimethyl, 8-Chloro-6,6-dimethyl-6H-2-benzopyran-4-carbaldehyde
| Molecular Formula | C12H11ClO2 |
|---|---|
| Molecular Weight | 222.04 g/mol |
| LogP | 3.0722 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.04475 |
| Heavy Atoms | 15 |
| Complexity | 436.53848 |
Chemical Identifiers
| CAS Number | 62000-46-8 |
|---|---|
| SMILES | CC1(C=C2C(=COC=C2C(=C1)Cl)C=O)C |
Product Overview
6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- (CAS 62000-46-8), with molecular formula C12H11ClO2 and molecular weight 222.04 g/mol. IUPAC: 8-chloro-6,6-dimethylisochromene-4-carbaldehyde.
Chemical Property Profile of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-
Property Insights of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-
The XLogP value of 3.0722 indicates that 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- has 0 hydrogen bond donor(s) and 2 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 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-?
The CAS number of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- is 62000-46-8.
What is the molecular formula of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-?
The molecular formula of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- is C12H11ClO2.
What is the molecular weight of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-?
The molecular weight of 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- is 222.04 g/mol.
Where can I buy 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-?
You can request a quote for 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 6H-2-Benzopyran-4-carboxaldehyde, 8-chloro-6,6-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.