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1578-57-0 | 2-fluorohexanoic acid
CAS No: 1578-57-0 Catalog No: AG01FN2F MDL No:MFCD19228149
Product Description
Catalog Number:
AG01FN2F
Chemical Name:
2-fluorohexanoic acid
CAS Number:
1578-57-0
Molecular Formula:
C6H11FO2
Molecular Weight:
134.1487
MDL Number:
MFCD19228149
IUPAC Name:
2-fluorohexanoic acid
InChI:
InChI=1S/C6H11FO2/c1-2-3-4-5(7)6(8)9/h5H,2-4H2,1H3,(H,8,9)
InChI Key:
CDWPBSAPAJJTHA-UHFFFAOYSA-N
SMILES:
CCCCC(C(=O)O)F
NSC Number:
84355
Properties
Complexity:
93.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.074g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.15g/mol
Monoisotopic Mass:
134.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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