Coumarin 35
TL;DR: Coumarin 35 (CAS 41934-47-8) is a chemical compound with molecular formula C14H14F3NO2 and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(diethylamino)-4-(trifluoromethyl)chromen-2-one
Also Known As: coumarin 481, Coumarin 35, n-Octylcyanide, 7-Diethylamino-4-(trifluoromethyl)coumarin, Coumarin 152A
| Molecular Formula | C14H14F3NO2 |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.09766 |
| Heavy Atoms | 20 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 41934-47-8 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F |
| InChIKey | UIMOXRDVWDLOHW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Coumarin 35 (CAS 41934-47-8), with molecular formula C14H14F3NO2 and molecular weight 285.10 g/mol. IUPAC: 7-(diethylamino)-4-(trifluoromethyl)chromen-2-one.
Chemical Property Profile of Coumarin 35
Property Insights of Coumarin 35
The XLogP value of 3.6 indicates that Coumarin 35 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Coumarin 35 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coumarin 35 has 0 hydrogen bond donor(s) and 6 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 Coumarin 35?
The CAS number of Coumarin 35 is 41934-47-8.
What is the molecular formula of Coumarin 35?
The molecular formula of Coumarin 35 is C14H14F3NO2.
What is the molecular weight of Coumarin 35?
The molecular weight of Coumarin 35 is 285.10 g/mol.
Where can I buy Coumarin 35?
You can request a quote for Coumarin 35 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coumarin 35?
Yes, KEHONG BIO provides custom synthesis services for Coumarin 35 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.