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467-43-6

467-43-6 structural image
Product Name: Methitural
Formula: C12H20N2O2S2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 2225 2240

COMPUTED DESCRIPTORS

Molecular Weight 288.4 g/mol
XLogP3 3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 288.09662023 g/mol
Monoisotopic Mass 288.09662023 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 338
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

PRODUCT INTRODUCTION

description

Methitural is a member of barbiturates.