Basic information
- CAS
73728-83-3- Standard SMILES
CCN(CC)C(=S)N(C(=S)N(CC)CC)c1ccc(N(CC)CC)cc1- InChIKey
ZPIPXXYNETUJHJ-UHFFFAOYSA-N- Molecular formula
- C20H34N4S2
- Average molar mass
- 394.6 g/mol
- Monoisotopic mass
- 394.22248945
Names & identifiers
- Preferred name
- Biuret, 3-(p-diethylaminophenyl)-2,4-dithio-1,1,5,5-tetraethyl-
- IUPAC
- 1-[4-(diethylamino)phenyl]-1-(diethylcarbamothioyl)-3,3-diethylthiourea
- English name
- 1,1,5,5-Tetraethyl-3-[4-(diethylamino)phenyl]dithiobiuret
- Molecular formula
- C20H34N4S2
- Molecular weight
- 394.64
Names & synonyms
73728-83-31,1,5,5-Tetraethyl-3-(p-diethylaminophenyl)-2,4-dithiobiuretBIURET, 3-(p-DIETHYLAMINOPHENYL)-2,4-DITHIO-1,1,5,5-TETRAETHYL-3-(p-Diethylaminophenyl)-2,4-dithio-1,1,5,5-tetraethylbiuretDTXSID70224054RefChem:329988DTXCID70146545N-[4-(Diethylamino)phenyl]-N,N,N',N'-tetraethyl-2-imidodithiodicarbonic diamide1,1,5,5-Tetraethyl-3-[4-(diethylamino)phenyl]dithiobiuretThioimidodicarbonic diamide ([(H2N)C(S)]2NH), 2-[4-(diethylamino)phenyl]-N,N,N',N'-tetraethyl-
Database identifiers
- CAS
73728-83-3- PubChem CID
- 52336
- DTXSID
DTXSID70224054- Nikkaji
- J78.070G
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 400
Physicochemical properties
- Boiling point
- 489.7 · 489.7±47.0 °C(Predicted)
- Density
- 1.111 · 1.111±0.06 g/cm3(Predicted)
- pka
- 5.41 · 5.41±0.32(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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