Ammonium thiocyanate
Properties
- Molecular formula
- CH4N2S
- Molar mass
- 76.12 g/mol
- Exact mass
- 76.0095 Da
- Density
- 1.31 g/mL
- Melting point
- 149.6 °C
- Boiling point
- 40 °C
- logP
- 0.56Crippen estimate
- Polar surface area
- 58.8 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed99.7% of notifiers
- H312 Harmful in contact with skin98.8% of notifiers
- H318 Causes serious eye damage38.6% of notifiers
- H332 Harmful if inhaled99.1% of notifiers
- H412 Harmful to aquatic life with long lasting effects88.2% of notifiers
Aggregated from 347 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P321, P330, P362+P364, P501
Identifiers
CAS number
1762-95-4SMILES
N.N#CSInChIKey
SOIFLUNRINLCBN-UHFFFAOYSA-NInChI
InChI=1S/CHNS.H3N/c2-1-3;/h3H;1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- Thiocyanic acid, ammonium salt (1:1)
- Thiocyanic acid, ammonium salt
- Ammonium isothiocyanate
- Ammonium sulfocyanate
- Ammonium rhodanate
- Rhodanid
- Ammonium cyanide sulfide (NH4CNS)
Safety data sheets
One stored sheet lists this compound in section 3, matched by the CAS number 1762-95-4. Each row opens the sheet with its composition and PDF.
Work with Ammonium 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
Boiling point under vacuumAt any pressure, from its normal boiling point
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
Copper(I) thiocyanate1111-67-7Salt
Barium thiocyanate2092-17-3Salt
Potassium thiocyanate333-20-0Salt
Cobalt(II) thiocyanate3017-60-5Salt
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
Similar compounds
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds