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463-56-9

463-56-9 structural image
Product Name: Thiocyanic acid
Formula: CHNS
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless gas or white solid (depends on degree of polymerization); [Merck Index] Colorless liquid; mp = 5 deg C; [ICSC]
Melting Point 5 °C
Solubility Solubility in water: good
Vapor Density Relative vapor density (air = 1): 2.0
Vapor Pressure 4.73 [mmHg]
LogP 0.58 (estimated)
Chemical Classes Other Classes -> Organic Acids

COMPUTED DESCRIPTORS

Molecular Weight 59.09 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 58.98297021 g/mol
Monoisotopic Mass 58.98297021 g/mol
Topological Polar Surface Area 24.8 Ų
Heavy Atom Count 3
Formal Charge 0
Complexity 31.3
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

PRODUCT INTRODUCTION

description

Thiocyanic acid is a hydracid that is cyanic acid in which the oxygen is replaced by a sulfur atom. It has a role as an Escherichia coli metabolite. It is a hydracid, a one-carbon compound and an organosulfur compound. It is a conjugate acid of a thiocyanate. It is a tautomer of an isothiocyanic acid.