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Home > Fluorides > 113933-95-2
113933-95-2 | Phosphonic acid, (2,2,3,3,4,4,5,5,6,6-decafluorohexyl)- (9CI)
CAS No: 113933-95-2 Catalog No: AG000A3Y MDL No:
Product Description
Catalog Number:
AG000A3Y
Chemical Name:
Phosphonic acid, (2,2,3,3,4,4,5,5,6,6-decafluorohexyl)- (9CI)
CAS Number:
113933-95-2
Molecular Formula:
C6H5F10O3P
Molecular Weight:
346.0599
IUPAC Name:
2,2,3,3,4,4,5,5,6,6-decafluorohexylphosphonic acid
InChI:
InChI=1S/C6H5F10O3P/c7-2(8)4(11,12)6(15,16)5(13,14)3(9,10)1-20(17,18)19/h2H,1H2,(H2,17,18,19)
InChI Key:
SAPCVXPHUTVQEM-UHFFFAOYSA-N
SMILES:
FC(C(C(C(C(CP(=O)(O)O)(F)F)(F)F)(F)F)(F)F)F
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.982g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
346.061g/mol
Monoisotopic Mass:
345.982g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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