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57361-47-4

57361-47-4 structural image
Product Name: METHYL THIOCYANOFORMATE
Formula: C3H3NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 117.13 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 116.98844951 g/mol
Monoisotopic Mass 116.98844951 g/mol
Topological Polar Surface Area 75.4 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 113
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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