![Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester structure](/static/products/6345/63450-46-4.webp)
Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester
TL;DR: Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester (CAS 63450-46-4) is a chemical compound with molecular formula C13H10F3NO4 and molecular weight 301.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamate
Also Known As: 1-hydroxy-2-naphthoylacetophenone, ethyl N-[2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl]carbamate, Carbamic acid, [2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester, ethyl[2-oxo-4-(trifluoromethyl)-2h-chromen-7-yl]carbamate, Ethyl (2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamate
| Molecular Formula | C13H10F3NO4 |
|---|---|
| Molecular Weight | 301.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.05618 |
| Heavy Atoms | 21 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 63450-46-4 |
|---|---|
| SMILES | CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F |
| InChIKey | VUJLMASTRUYUHD-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester (CAS 63450-46-4), with molecular formula C13H10F3NO4 and molecular weight 301.06 g/mol. IUPAC: ethyl N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamate.
Chemical Property Profile of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester
Property Insights of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester. Following Lipinski's Rule of Five, Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester has 1 hydrogen bond donor(s) and 7 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 Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester?
The CAS number of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester is 63450-46-4.
What is the molecular formula of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester?
The molecular formula of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester is C13H10F3NO4.
What is the molecular weight of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester?
The molecular weight of Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester is 301.06 g/mol.
Where can I buy Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester?
You can request a quote for Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.