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478079-86-6

478079-86-6 structural image
Product Name: 1-(2-CHLORO-4-FLUOROPHENOXY)-3-[(4-METHYLPHENYL)SULFONYL]-2-PROPANOL
Formula: C16H16ClFO4S
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COMPUTED DESCRIPTORS

Molecular Weight 358.8 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 358.0441860 g/mol
Monoisotopic Mass 358.0441860 g/mol
Topological Polar Surface Area 72 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 459
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes