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19725-44-1 | 4H-1-Benzopyran-4-one, 7-methoxy-2-methyl-3-phenyl-
CAS No: 19725-44-1 Catalog No: AG002AP5 MDL No:MFCD00597215
Product Description
Catalog Number:
AG002AP5
Chemical Name:
4H-1-Benzopyran-4-one, 7-methoxy-2-methyl-3-phenyl-
CAS Number:
19725-44-1
Molecular Formula:
C17H14O3
Molecular Weight:
266.2913
MDL Number:
MFCD00597215
IUPAC Name:
7-methoxy-2-methyl-3-phenylchromen-4-one
InChI:
InChI=1S/C17H14O3/c1-11-16(12-6-4-3-5-7-12)17(18)14-9-8-13(19-2)10-15(14)20-11/h3-10H,1-2H3
InChI Key:
XRGWZIGGCNSFRY-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C
NSC Number:
605906
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.094g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.296g/mol
Monoisotopic Mass:
266.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| 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 |
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