CASIMIROIN

Modify Date: 2025-09-20 20:53:20

CASIMIROIN Structure
CASIMIROIN structure
Common Name CASIMIROIN
CAS Number 477-89-4 Molecular Weight 233.22000
Density 1.41g/cm3 Boiling Point 377.3ºC at 760 mmHg
Molecular Formula C12H11NO4 Melting Point N/A
MSDS N/A Flash Point 182ºC

 Names

Name 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.41g/cm3
Boiling Point 377.3ºC at 760 mmHg
Molecular Formula C12H11NO4
Molecular Weight 233.22000
Flash Point 182ºC
Exact Mass 233.06900
PSA 49.69000
LogP 1.27580
Vapour Pressure 6.81E-06mmHg at 25°C
Index of Refraction 1.637
InChIKey DPXXJCMMMXZVSW-UHFFFAOYSA-N
SMILES COc1cc(=O)n(C)c2c3c(ccc12)OCO3

 CASIMIROINBioassay

View more

Name: Cytotoxicity against human LNCAP cells after 72 hrs by sulforhodamine B assay
Source: ChEMBL
Target: LNCaP
External Id: CHEMBL960913
Name: Cytotoxicity against human Lu cells after 72 hrs by sulforhodamine B assay
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL960914
Name: QR2 Assay and IC50 Value Determination from Article 10.1021/jm801335z: "Synthesis of ...
Source: BindingDB
Target: N/A
External Id: BindingDB_3194_1
Name: Cytotoxicity against mouse Hepa-1c1c7 cells after 72 hrs by sulforhodamine B assay
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL960911
Name: Cytotoxicity against human MCF7 cells after 72 hrs by sulforhodamine B assay
Source: ChEMBL
Target: MCF7
External Id: CHEMBL960912
Name: Inhibition of human quinone reductase 2 expressed in Escherichia coli BL21(DE3) incub...
Source: ChEMBL
Target: Ribosyldihydronicotinamide dehydrogenase [quinone]
External Id: CHEMBL960909
Name: Inhibition of aromatase after 30 mins by fluorescence assay
Source: ChEMBL
Target: Aromatase
External Id: CHEMBL960910
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 Synonyms

Casimiroin
XM5
4-Methoxy-1-methyl-7,8-methylendioxy-2-oxo-chinolin
imiroine
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