Basic information
- CAS
6290-92-2- Standard SMILES
Br.Br.N=C(N)SCCCCCSC(=N)N- InChIKey
CEOUMSBDGSXUHQ-UHFFFAOYSA-N- Molecular formula
- C7H18Br2N4S2
- Average molar mass
- 382.2 g/mol
- Monoisotopic mass
- 379.93396
Names & identifiers
- Preferred name
- Pseudourea, 2,2'-pentamethylenebis(2-thio-, dihydrobromide
- IUPAC
- 5-carbamimidoylsulfanylpentyl carbamimidothioate;dihydrobromide
Names & synonyms
Pseudourea, 2,2'-pentamethylenebis(2-thio-, dihydrobromideRefChem:10970986290-92-2USAF EL-3Pentamethylene isothiourea dihydrobromide5-carbamimidoylsulfanylpentyl carbamimidothioate;dihydrobromidePentamethyleneisothiourea dihydrobromideNSC 8552,2'-Pentamethylene-bis(2-thiopseudourea), dihydrobromide
Database identifiers
- CAS
6290-92-2- PubChem CID
- 80508
Properties
Computed structural properties
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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