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1342788-79-7 | 2-(3-Chloro-4-fluorobenzoyl)furan
CAS No: 1342788-79-7 Catalog No: AG01FEDX MDL No:
Product Description
Catalog Number:
AG01FEDX
Chemical Name:
2-(3-Chloro-4-fluorobenzoyl)furan
CAS Number:
1342788-79-7
Molecular Formula:
C11H6ClFO2
Molecular Weight:
224.6155
IUPAC Name:
(3-chloro-4-fluorophenyl)-(furan-2-yl)methanone
InChI:
InChI=1S/C11H6ClFO2/c12-8-6-7(3-4-9(8)13)11(14)10-2-1-5-15-10/h1-6H
InChI Key:
IPMSIOJIQRBKIU-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1Cl)C(=O)c1ccco1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.004g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.615g/mol
Monoisotopic Mass:
224.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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