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16587-48-7

16587-48-7 structural image
Product Name: 2,5-DIMETHYLBENZOTHIOPHENE
Formula: C10H10S
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1409.9

COMPUTED DESCRIPTORS

Molecular Weight 162.25 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 162.05032149 g/mol
Monoisotopic Mass 162.05032149 g/mol
Topological Polar Surface Area 28.2 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 144
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes