CAS 2555-28-4 | 7-Methoxy-4-methyl-2H-chromen-2-one | CAS Number 2555-28-4

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2555-28-4 | 7-Methoxy-4-methyl-2H-chromen-2-one

CAS No: 2555-28-4 Catalog No: AG003NG5 MDL No:MFCD00009773

Product Description

Catalog Number:

AG003NG5

Chemical Name:

7-Methoxy-4-methyl-2H-chromen-2-one

CAS Number:

2555-28-4

Molecular Formula:

C11H10O3

Molecular Weight:

190.1953

MDL Number:

MFCD00009773

IUPAC Name:

7-methoxy-4-methylchromen-2-one

InChI:

InChI=1S/C11H10O3/c1-7-5-11(12)14-10-6-8(13-2)3-4-9(7)10/h3-6H,1-2H3

InChI Key:

UDFPKNSWSYBIHO-UHFFFAOYSA-N

SMILES:

COc1ccc2c(c1)oc(=O)cc2C

EC Number:

607-744-0

NSC Number:

688805

Properties

Complexity:

270

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.198g/mol

Monoisotopic Mass:

190.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2

Literature

Title	Journal
Structural insights into hydroxycoumarin-induced apoptosis in U-937 cells.	Bioorganic & medicinal chemistry 20080301
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Fluorescence quenching of coumarins by halide ions.	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040301