Basic information
- CAS
91469-16-8- Standard SMILES
NNC(=S)NN1CCCCC1- InChIKey
ZBIUNSHBFMMYCZ-UHFFFAOYSA-N- Molecular formula
- C6H14N4S
- Average molar mass
- 174.27 g/mol
- Monoisotopic mass
- 174.09391764
Names & identifiers
- Preferred name
- N-(Piperidin-1-yl)hydrazinecarbothioamide
- IUPAC
- 1-amino-3-piperidin-1-ylthiourea
- English name
- 4-(N-PIPERIDINO)-THIOSEMICARBAZIDE
- Molecular formula
- C6H14N4S
- Molecular weight
- 174.27
Names & synonyms
91469-16-8N-(Piperidin-1-yl)hydrazinecarbothioamideDTXSID00654426RefChem:362860DTXCID606051764-(N-Piperidino)-thiosemicarbazide1-amino-3-(1-piperidyl)thioureaMFCD057240111-amino-3-piperidin-1-ylthiourea4-piperidinothiosemicarbazideC6H14N4SSCHEMBL28199898
Show more names
Hydrazinecarbothioamide, N-1-piperidinyl-
AKOS006333756
Database identifiers
- CAS
91469-16-8- PubChem CID
- 40468289
- DTXSID
DTXSID00654426
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 85.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 133
Physicochemical properties
- Melting point
- 170 · 170-171
- Boiling point
- 280.3 · 280.3±23.0 °C(Predicted)
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- pka
- 11.23 · 11.23±0.70(Predicted)
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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