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Home > Fluorides > 148043-70-3
148043-70-3 | Hexanoic acid, 5,5,6,6,6-pentafluoro-
CAS No: 148043-70-3 Catalog No: AG001FDZ MDL No:MFCD04972954
Product Description
Catalog Number:
AG001FDZ
Chemical Name:
Hexanoic acid, 5,5,6,6,6-pentafluoro-
CAS Number:
148043-70-3
Molecular Formula:
C6H7F5O2
Molecular Weight:
206.1106
MDL Number:
MFCD04972954
IUPAC Name:
5,5,6,6,6-pentafluorohexanoic acid
InChI:
InChI=1S/C6H7F5O2/c7-5(8,6(9,10)11)3-1-2-4(12)13/h1-3H2,(H,12,13)
InChI Key:
VQNQZVLVFCPHTP-UHFFFAOYSA-N
SMILES:
OC(=O)CCCC(C(F)(F)F)(F)F
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.037g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.112g/mol
Monoisotopic Mass:
206.037g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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