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45021-39-4 | 5,5,5-trifluoro-4,4-dihydroxypentanoic acid
CAS No: 45021-39-4 Catalog No: AG01FP5P MDL No:
Product Description
Catalog Number:
AG01FP5P
Chemical Name:
5,5,5-trifluoro-4,4-dihydroxypentanoic acid
CAS Number:
45021-39-4
IUPAC Name:
5,5,5-trifluoro-4,4-dihydroxypentanoic acid
InChI:
InChI=1S/C5H7F3O4/c6-5(7,8)4(11,12)2-1-3(9)10/h11-12H,1-2H2,(H,9,10)
InChI Key:
TUNXCOWHUZSENS-UHFFFAOYSA-N
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.03g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
188.102g/mol
Monoisotopic Mass:
188.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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