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727-80-0 | 2-ACETYL-BENZO[F]CHROMEN-3-ONE
CAS No: 727-80-0 Catalog No: AG00FIBD MDL No:MFCD00445975
Product Description
Catalog Number:
AG00FIBD
Chemical Name:
2-ACETYL-BENZO[F]CHROMEN-3-ONE
CAS Number:
727-80-0
Molecular Formula:
C15H10O3
Molecular Weight:
238.2381
MDL Number:
MFCD00445975
IUPAC Name:
2-acetylbenzo[f]chromen-3-one
InChI:
InChI=1S/C15H10O3/c1-9(16)12-8-13-11-5-3-2-4-10(11)6-7-14(13)18-15(12)17/h2-8H,1H3
InChI Key:
UAMPJVJAALGMNG-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc2c(oc1=O)ccc1c2cccc1
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.063g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.242g/mol
Monoisotopic Mass:
238.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Synthesis and selective human monoamine oxidase inhibition of 3-carbonyl, 3-acyl, and 3-carboxyhydrazido coumarin derivatives. | European journal of medicinal chemistry 20111001 |
| 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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