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52192-60-6 | 2-(3-Fluoro-4-methoxybenzoyl)furan
CAS No: 52192-60-6 Catalog No: AG01EWCC MDL No:
Product Description
Catalog Number:
AG01EWCC
Chemical Name:
2-(3-Fluoro-4-methoxybenzoyl)furan
CAS Number:
52192-60-6
Molecular Formula:
C12H9FO3
Molecular Weight:
220.1965
IUPAC Name:
(3-fluoro-4-methoxyphenyl)-(furan-2-yl)methanone
InChI:
InChI=1S/C12H9FO3/c1-15-10-5-4-8(7-9(10)13)12(14)11-3-2-6-16-11/h2-7H,1H3
InChI Key:
HPFUUFJWACCBRM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)C(=O)c1ccco1
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.054g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.199g/mol
Monoisotopic Mass:
220.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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