Copper(I) thiocyanate

CCuNSCAS 1111-67-7121.62 g/mol

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NS−Cu+
NitrileThiol

Properties

Molecular formula
CCuNS
Molar mass
121.62 g/mol
Exact mass
120.9047 Da
logP
0.39Crippen estimate
Polar surface area
23.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
1111-67-7
SMILES
N#C[S-].[Cu+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

11 names
  • Thiocyanic acid, copper(1+) salt (1:1)
  • Thiocyanic acid, copper(1+) salt
  • Copper thiocyanate
  • Cuprous thiocyanate
  • Copper thiocyanate (Cu(NCS))
  • Copper monothiocyanate
  • Copper(1+) thiocyanate
  • Cuprous thiocyanate (CuCNS)
  • Copper thiocyanate (CuCNS)
  • Copper(I) thiocyanide
  • CuSCN

Work with Copper(I) thiocyanate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Thiocyanic acid463-56-9Parent compound Sodium thiocyanate540-72-7Salt Ammonium thiocyanate1762-95-4Salt Barium thiocyanate2092-17-3Salt Cobalt(II) thiocyanate3017-60-5Salt Potassium thiocyanate333-20-0Salt Lead(II) thiocyanate592-87-0Salt Mercury(II) thiocyanate592-85-8Salt Silver thiocyanate1701-93-5Salt Calcium thiocyanate2092-16-2Salt 1-Butyl-3-methylimidazolium thiocyanate344790-87-0Salt Lithium thiocyanate hydrate123333-85-7Salt

Elsewhere

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