N-(2-Thienylmethyl)hydrazinecarbothioamide
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Basic information
- CAS
328288-82-0- Standard SMILES
NNC(=S)NCc1cccs1- InChIKey
NBBHGLQLAPFLFP-UHFFFAOYSA-N- Molecular formula
- C6H9N3S2
- Average molar mass
- 187.3 g/mol
- Monoisotopic mass
- 187.02378965
Overview
N-(2-thienylmethyl)hydrazine-1-carbothioamide is a heteroarene.
Names & identifiers
- Preferred name
- N-(2-Thienylmethyl)hydrazinecarbothioamide
- IUPAC
- 1-amino-3-(thiophen-2-ylmethyl)thiourea
- English name
- N-(2-thienylmethyl)-1-hydrazinecarbothioamide
- Molecular formula
- C6H9N3S2
- Molecular weight
- 187.29
Names & synonyms
328288-82-0N-(2-Thienylmethyl)hydrazinecarbothioamideRefChem:3610393-amino-1-[(thiophen-2-yl)methyl]thioureaN-(2-thienylmethyl)-1-hydrazinecarbothioamide1-amino-3-(thiophen-2-ylmethyl)thioureaorb3031308SCHEMBL27632920CHEBI:195014DTXSID301268480Fr12593CCG-50286
Show more names
Hydrazinecarbothioamide, N-(2-thienylmethyl)-
MFCD013128501-amino-3-(2-thienylmethyl)thioureaAKOS005108056MS-2014CS-0248495N-(2-thienylmethyl)hydrazine-1-carbothioamideEN300-399880N-[(Thiophen-2-yl)methyl]hydrazinecarbothioamide
Database identifiers
- CAS
328288-82-0- PubChem CID
- 676437
- DTXSID
DTXSID301268480- ChEBI
CHEBI:195014
Properties
Computed structural propertiesFilling in
- XLogP
- 0.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- Boiling point
- 327.7 · 327.7±44.0 °C(Predicted)
- Density
- 1.356 · 1.356±0.06 g/cm3(Predicted)
- pka
- 10.49 · 10.49±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Additional notes
DefinitionChEBI: N-(2-thienylmethyl)hydrazine-1-carbothioamide is a heteroarene.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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