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1260011-02-6

1260011-02-6 | 1H-Inden-1-one, 4-fluoro-2,3-dihydro-5-hydroxy-

CAS No: 1260011-02-6 Catalog No: AG000QP5 MDL No:MFCD18208897

Product Description

Catalog Number:
AG000QP5
Chemical Name:
1H-Inden-1-one, 4-fluoro-2,3-dihydro-5-hydroxy-
CAS Number:
1260011-02-6
Molecular Formula:
C9H7FO2
Molecular Weight:
166.1491
MDL Number:
MFCD18208897
IUPAC Name:
4-fluoro-5-hydroxy-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H7FO2/c10-9-6-2-3-7(11)5(6)1-4-8(9)12/h1,4,12H,2-3H2
InChI Key:
JGLNYXVRFNVKBQ-UHFFFAOYSA-N
SMILES:
O=C1CCc2c1ccc(c2F)O

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.151g/mol
Monoisotopic Mass:
166.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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