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759-02-4 | 3-Fluoropentane-2,4-dione
CAS No: 759-02-4 Catalog No: AG005HCR MDL No:MFCD00215824
Product Description
Catalog Number:
AG005HCR
Chemical Name:
3-Fluoropentane-2,4-dione
CAS Number:
759-02-4
Molecular Formula:
C5H7FO2
Molecular Weight:
118.1063
MDL Number:
MFCD00215824
IUPAC Name:
3-fluoropentane-2,4-dione
InChI:
InChI=1S/C5H7FO2/c1-3(7)5(6)4(2)8/h5H,1-2H3
InChI Key:
LELFVORHOKZNGY-UHFFFAOYSA-N
SMILES:
FC(C(=O)C)C(=O)C
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.043g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.107g/mol
Monoisotopic Mass:
118.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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