Specifications
- Purity
- ≥97% (NMR)
- Appearance
- White to off-white powder
- Identity
- 1H-NMR
Properties
- Solvents
- Soluble in DMSO.
Documentation
- Safety Data Sheet (SDS)
- CDX B0299 MSDS.pdf
Available from stock
7-Benzyloxy-4-trifluoromethycoumarin
- SKU
- B0299
Categories: Fluorescent Detection, Fluorescent Detection
- Synonyms
- BFC
- 220001-53-6
- CAS-Number
- C17H11F3O3
- Molecular Formula
- 320.26
- Molecular Weight
For Research Use Only. Not Intended for Diagnostic or Therapeutic Use.
- Shipping
- AMBIENT
- Short Term Storage
- RT
- Long Term Storage
- -20°C
- Handling Advice
- Protect from light and moisture.
- Use / Stability
- Stable for at least 2 years after receipt when stored at -20°C.
- Hazard statements
- H302 + H312 + H332
- Precautionary statements
- P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312
- GHS Symbol
- GHS07
- Signal word
- Warning
- Transportation
- Not dangerous goods
- Description
- 7-Benzyloxy-4-trifluoromethycoumarin is a fluorescent substrate for cytochrome P450 family members CYP1A2, CYP3A4 and potentially others. Has been used in high-throughput screens in fluorometric p450 activity assays and is metabolized to the fluorescent metabolite 7-Hydroxy-4-trifluoromethylcoumarin (HFC) with λex=410nm; λem=530nm.
- Smiles
- O=C1C=C(C(F)(F)F)C2=C(C=C(OCC3=CC=CC=C3)C=C2)O1
- InChi Key
- WVKLERKKJXUPIK-UHFFFAOYSA-N
- References
- (1) A.B. Renwick, et al., Xenobiotica 30, 955 (2000) , (2) A.B. Renwick, et al., Xenobiotica 31, 861 (2001) , (3) K.K. Khan & J.R. Halpert, Chem. Res. Toxicol. 15, 806 (2002) , (4) V. Zlabek & G. Zamaratskaia, Animal 6, 633 (2012) , (5) Y.T. Ung, et al., High-Throughput 7, 29 (2018) (Review) , (6) H. Raunio, et al., Int. J. Mol. Sci. 21, 4708 (2020) (Review)
- InChi
- InChI=1S/C17H11F3O3/c18-17(19,20)14-9-16(21)23-15-8-12(6-7-13(14)15)22-10-11-4-2-1-3-5-11/h1-9H,10H2
7-Benzyloxy-4-trifluoromethycoumarin is a fluorescent substrate for cytochrome P450 family members CYP1A2, CYP3A4 and potentially others. Has been used in high-throughput screens in fluorometric p450 activity assays and is metabolized to the fluorescent metabolite 7-Hydroxy-4-trifluoromethylcoumarin (HFC) with λex=410nm; λem=530nm.
Additional information
| Synonyms | BFC |
|---|---|
| Purity | ≥97% (NMR) |
| Appearance | White to off-white powder |
| CAS-Number | 220001-53-6 |
| Molecular Formula | C17H11F3O3 |
| Molecular Weight | 320.26 |
| Identity | 1H-NMR |
| Solvents | Soluble in DMSO. |
| Smiles | O=C1C=C(C(F)(F)F)C2=C(C=C(OCC3=CC=CC=C3)C=C2)O1 |
| InChi Key | WVKLERKKJXUPIK-UHFFFAOYSA-N |
| Shipping | AMBIENT |
| Short Term Storage | RT |
| Long Term Storage | -20°C |
| Handling Advice | Protect from light and moisture. |
| Use / Stability | Stable for at least 2 years after receipt when stored at -20°C. |
| Hazard statements | H302 + H312 + H332 |
| Precautionary statements | P280 – P301 + P312 + P330 – P302 + P352 + P312 – P304 + P340 + P312 |
| GHS Symbol | GHS07 |
| Signal word | Warning |
| Transportation | Not dangerous goods |
| References | (1) A.B. Renwick, et al., Xenobiotica 30, 955 (2000), (2) A.B. Renwick, et al., Xenobiotica 31, 861 (2001), (3) K.K. Khan & J.R. Halpert, Chem. Res. Toxicol. 15, 806 (2002), (4) V. Zlabek & G. Zamaratskaia, Animal 6, 633 (2012), (5) Y.T. Ung, et al., High-Throughput 7, 29 (2018) (Review), (6) H. Raunio, et al., Int. J. Mol. Sci. 21, 4708 (2020) (Review) |
| InChi | InChI=1S/C17H11F3O3/c18-17(19,20)14-9-16(21)23-15-8-12(6-7-13(14)15)22-10-11-4-2-1-3-5-11/h1-9H,10H2 |
| Quantity | 50 mg, 250 mg, Bulk |
