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Home > Fluorides > 1223532-17-9
1223532-17-9 | 1H-Inden-1-one, 5-fluoro-2,3-dihydro-4-methyl-
CAS No: 1223532-17-9 Catalog No: AG001755 MDL No:
Product Description
Catalog Number:
AG001755
Chemical Name:
1H-Inden-1-one, 5-fluoro-2,3-dihydro-4-methyl-
CAS Number:
1223532-17-9
Molecular Formula:
C10H9FO
Molecular Weight:
164.1763
IUPAC Name:
5-fluoro-4-methyl-2,3-dihydroinden-1-one
InChI:
InChI=1S/C10H9FO/c1-6-7-3-5-10(12)8(7)2-4-9(6)11/h2,4H,3,5H2,1H3
InChI Key:
TWJDFKWNGVETDL-UHFFFAOYSA-N
SMILES:
O=C1CCc2c1ccc(c2C)F
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.179g/mol
Monoisotopic Mass:
164.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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