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147919-60-6 | 4H-1-Benzopyran-4-one, 6-chloro-7-methyl-2-phenyl-
CAS No: 147919-60-6 Catalog No: AG001FAV MDL No:MFCD00209563
Product Description
Catalog Number:
AG001FAV
Chemical Name:
4H-1-Benzopyran-4-one, 6-chloro-7-methyl-2-phenyl-
CAS Number:
147919-60-6
Molecular Formula:
C16H11ClO2
Molecular Weight:
270.7103
MDL Number:
MFCD00209563
IUPAC Name:
6-chloro-7-methyl-2-phenylchromen-4-one
InChI:
InChI=1S/C16H11ClO2/c1-10-7-16-12(8-13(10)17)14(18)9-15(19-16)11-5-3-2-4-6-11/h2-9H,1H3
InChI Key:
UEURAPSJJCDACA-UHFFFAOYSA-N
SMILES:
Clc1cc2c(=O)cc(oc2cc1C)c1ccccc1
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.045g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.712g/mol
Monoisotopic Mass:
270.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Fatty acid synthase inhibitors from plants: isolation, structure elucidation, and SAR studies. | Journal of natural products 20021201 |
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