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852180-41-7

852180-41-7 structural image
Product Name: 4-(3-ISOCYANATOPHENYL)-2-METHYL-1,3-THIAZOLE
Formula: C11H8N2OS
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COMPUTED DESCRIPTORS

Molecular Weight 216.26 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 216.03573406 g/mol
Monoisotopic Mass 216.03573406 g/mol
Topological Polar Surface Area 70.6 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 265
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

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