5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate

Modify Date: 2025-09-05 14:33:20

5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate Structure
5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate structure
Common Name 5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate
CAS Number 6320-37-2 Molecular Weight 398.36300
Density 1.36g/cm3 Boiling Point 578.7ºC at 760 mmHg
Molecular Formula C21H18O8 Melting Point N/A
MSDS N/A Flash Point 253.2ºC

 Names

Name [5-acetyloxy-3-methoxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl] acetate

 Chemical & Physical Properties

Density 1.36g/cm3
Boiling Point 578.7ºC at 760 mmHg
Molecular Formula C21H18O8
Molecular Weight 398.36300
Flash Point 253.2ºC
Exact Mass 398.10000
PSA 101.27000
LogP 3.32780
Index of Refraction 1.6
InChIKey OXRCQEMNONCHMK-UHFFFAOYSA-N
SMILES COc1ccc(-c2oc3cc(OC(C)=O)cc(OC(C)=O)c3c(=O)c2OC)cc1

 Synthetic Route

~%

5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate Structure

5-(Acetyloxy)-3...

CAS#:6320-37-2

Literature: Zemplen; Bognar Chemische Berichte, 1941 , vol. 74, p. 1783,1786

 Precursor & DownStream

Precursor  2

DownStream  0

 Bioassay

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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: In vitro cytotoxic potency against NCI-60 human tumor cell line
Source: ChEMBL
Target: Panel NCI-60 (60 carcinoma cell lines)
External Id: CHEMBL749609
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
Name: uHTS identification of small molecule modulators of NR3A
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1015-NR3A-Primary-Assay
Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
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