3,4-二氢-1,2-萘二甲酸酐
TL;DR: 3,4-二氢-1,2-萘二甲酸酐 (CAS 37845-14-0) is a chemical compound with molecular formula C12H8O3 and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-二氢-1,2-萘二甲酸酐
4,5-dihydrobenzo[e][2]benzofuran-1,3-dione
Also Known As: 3,4-Dihydro-1,2-naphthalenedicarboxylic anhydride, Ethyl 3-iodopropanoate, 4,5-Dihydronaphtho[1,2-c]furan-1,3-dione, 3,4-Dihydronaphthalic anhydride, 4,5-dihydrobenzo[e][2]benzofuran-1,3-dione
| Molecular Formula | C12H8O3 |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.04735 |
| Heavy Atoms | 15 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 37845-14-0 |
|---|---|
| SMILES | C1CC2=C(C3=CC=CC=C31)C(=O)OC2=O |
| InChIKey | FSVOMBDSHMMPER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-二氢-1,2-萘二甲酸酐 (CAS 37845-14-0), with molecular formula C12H8O3 and molecular weight 200.05 g/mol. IUPAC: 4,5-dihydrobenzo[e][2]benzofuran-1,3-dione.
Chemical Property Profile of 3,4-二氢-1,2-萘二甲酸酐
Property Insights of 3,4-二氢-1,2-萘二甲酸酐
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-二氢-1,2-萘二甲酸酐. With a topological polar surface area (TPSA) of 43.4 Ų, 3,4-二氢-1,2-萘二甲酸酐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-二氢-1,2-萘二甲酸酐 has 0 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 3,4-二氢-1,2-萘二甲酸酐?
The CAS number of 3,4-二氢-1,2-萘二甲酸酐 is 37845-14-0.
What is the molecular formula of 3,4-二氢-1,2-萘二甲酸酐?
The molecular formula of 3,4-二氢-1,2-萘二甲酸酐 is C12H8O3.
What is the molecular weight of 3,4-二氢-1,2-萘二甲酸酐?
The molecular weight of 3,4-二氢-1,2-萘二甲酸酐 is 200.05 g/mol.
Where can I buy 3,4-二氢-1,2-萘二甲酸酐?
You can request a quote for 3,4-二氢-1,2-萘二甲酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-二氢-1,2-萘二甲酸酐?
Yes, KEHONG BIO provides custom synthesis services for 3,4-二氢-1,2-萘二甲酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.