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Home > Fluorides > 156909-07-8
156909-07-8 | 4H-1-Benzopyran-4-one, 2-(difluoromethyl)-
CAS No: 156909-07-8 Catalog No: AG001P3E MDL No:
Product Description
Catalog Number:
AG001P3E
Chemical Name:
4H-1-Benzopyran-4-one, 2-(difluoromethyl)-
CAS Number:
156909-07-8
Molecular Formula:
C10H6F2O2
Molecular Weight:
196.1502
IUPAC Name:
2-(difluoromethyl)chromen-4-one
InChI:
InChI=1S/C10H6F2O2/c11-10(12)9-5-7(13)6-3-1-2-4-8(6)14-9/h1-5,10H
InChI Key:
GKIYUOSVTAOJHU-UHFFFAOYSA-N
SMILES:
FC(c1cc(=O)c2c(o1)cccc2)F
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.034g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.153g/mol
Monoisotopic Mass:
196.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| 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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