Basic information
- CAS
52841-43-7- Standard SMILES
Br.Br.N=C(N)SCCCCCCCCCCCCSC(=N)N- InChIKey
HEURGAVWBXNVGC-UHFFFAOYSA-N- Molecular formula
- C14H32Br2N4S2
- Average molar mass
- 480.4 g/mol
- Monoisotopic mass
- 478.04351
Names & identifiers
- Preferred name
- Dodecane-1,12-diyl dicarbamimidothioate--hydrogen bromide (1/2)
- IUPAC
- 12-carbamimidoylsulfanyldodecyl carbamimidothioate;dihydrobromide
Names & synonyms
DTXSID7096731352841-43-7Dodecane-1,12-diyl dicarbamimidothioate--hydrogen bromide (1/2)RefChem:1083948DTXCID201394913Dodecane diisothiourea dihydrobromidePseudourea, dodecanebis(2'-thio-, dihydrobromide
Database identifiers
- CAS
52841-43-7- PubChem CID
- 104339
- DTXSID
DTXSID70967313
Properties
Computed structural properties
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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