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Home > Fluorides > 141716-55-4
141716-55-4 | Heptanoic acid, 3-fluoro-, (R)- (9CI)
CAS No: 141716-55-4 Catalog No: AG001GX6 MDL No:
Product Description
Catalog Number:
AG001GX6
Chemical Name:
Heptanoic acid, 3-fluoro-, (R)- (9CI)
CAS Number:
141716-55-4
Molecular Formula:
C7H13FO2
Molecular Weight:
148.1753
IUPAC Name:
3-fluoroheptanoic acid
InChI:
InChI=1S/C7H13FO2/c1-2-3-4-6(8)5-7(9)10/h6H,2-5H2,1H3,(H,9,10)
InChI Key:
KRKPIFPUTIFXIC-UHFFFAOYSA-N
SMILES:
CCCC[C@H](CC(=O)O)F
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.09g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.177g/mol
Monoisotopic Mass:
148.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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