Basic information
- CAS
33812-14-5- Standard SMILES
CN(C)C(=S)N(C(=S)N(C)C)c1ccccc1- InChIKey
ZWWUXDXOKQTSPQ-UHFFFAOYSA-N- Molecular formula
- C12H17N3S2
- Average molar mass
- 267.4 g/mol
- Monoisotopic mass
- 267.0863899
Names & identifiers
- Preferred name
- Biuret, 2,4-dithio-3-phenyl-1,1,5,5-tetramethyl-
- IUPAC
- 1-(dimethylcarbamothioyl)-3,3-dimethyl-1-phenylthiourea
- English name
- Phenylbis(dimethylthiocarbamoyl)amine
- Molecular formula
- C12H17N3S2
- Molecular weight
- 267.41
Names & synonyms
33812-14-5BIURET, 2,4-DITHIO-3-PHENYL-1,1,5,5-TETRAMETHYL-RefChem:1080039N,N-bis((dimethylamino)thiocarbonyl)anilineNSC-518809Thioimidodicarbonic diamide (((H2N)C(S))2NH), N,N,N',N'-tetramethyl-2-phenyl-Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,N',N'-tetramethyl-2-phenyl-N,N-bis[(dimethylamino)thiocarbonyl]anilineNSC 518809BRN 2980359AI3-621703-Phenyl-1,1,5,5-tetramethyl-2,4-dithiobiuret
Show more names
Phenylbis(dimethylthiocarbamoyl)amine1,1,5,5-Tetramethyl-3-phenyldithiobiuret
NSC518809JT5GNH8F9X4-12-00-00872 (Beilstein Handbook Reference)SCHEMBL14273121DTXSID70955396WLN: 1N1&YUS&NR&YUS&N1&1DS-0116983-Phenyl-1,5,5-tetramethyl-2,4-dithiobiuret
Database identifiers
- CAS
33812-14-5- PubChem CID
- 36602
- DTXSID
DTXSID70955396- UNII
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 263
Physicochemical properties
- Boiling point
- 339.2 · 339.2±25.0 °C(Predicted)
- Density
- 1.227 · 1.227±0.06 g/cm3(Predicted)
- pka
- 1.06 · 1.06±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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