CASIMIROIN

Modify Date: 2026-08-15 18:11:15

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

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

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

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

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

 Precursor & DownStream

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor  3

DownStream  0

 CASIMIROINBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

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

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

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

 CASIMIROIN | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the polar surface area (PSA) of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: Polar surface area (PSA) of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is 49.69000.
Q: What is the Chinese name of 477-89-4?
A: Chinese name of 477-89-4 is 477-89-4.
Q: What English synonyms does 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one have?
A: English synonyms of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one: Casimiroin, XM5, 4-Methoxy-1-methyl-7,8-methylendioxy-2-oxo-chinolin, imiroine.
Q: What is the molecular weight of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: Molecular weight of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is 233.22000.
Q: What is the LogP of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: LogP of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is 1.27580.
Q: What is the molecular formula of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: Molecular formula of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is C12H11NO4.
Q: What is the InChIKey of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: InChIKey of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is DPXXJCMMMXZVSW-UHFFFAOYSA-N.
Q: What is the boiling point of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: Boiling point of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is 377.3ºC at 760 mmHg.
Q: What is the English name of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: The English name of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one is 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one.
Q: What are the upstream materials of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one?
A: Related upstream materials(CAS) of 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one: 18107-18-1;90049-79-9;186581-53-3.

 CASIMIROINfactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Dayang Chem (Hangzhou) Co., Ltd.
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