Basic information
- CAS
1602-18-2- Standard SMILES
Br.Br.CCN=C(NCC)SCCN- InChIKey
WLSZCRGYFKVPFO-UHFFFAOYSA-N- Molecular formula
- C7H19Br2N3S
- Average molar mass
- 337.12 g/mol
- Monoisotopic mass
- 334.96664
Names & identifiers
- Preferred name
- Pseudourea, 2-(2-aminoethyl)-1,3-diethyl-2-thio-, dihydrobromide
- IUPAC
- 2-aminoethyl N,N'-diethylcarbamimidothioate;dihydrobromide
Names & synonyms
1602-18-2Pseudourea, 2-(2-aminoethyl)-1,3-diethyl-2-thio-, dihydrobromideRefChem:1097107USAF B-641,3-Diethyl-2-(2-aminoethyl)-isothiouronium dibromideDTXSID509362442-(2-Aminoethyl)-1,3-diethyl-2-thiopseudourea dihydrobromidePseudourea, 2-thio-, 1,3-diethyl-2-(2-aminoethyl)-, dibromide2-Aminoethyl-N',N''-diethylisothiuronium bromide hydrobromide2-Aminoethyl N,N'-diethylcarbamimidothioate--hydrogen bromide (1/2)
Database identifiers
- CAS
1602-18-2- PubChem CID
- 74140
- DTXSID
DTXSID50936244
Properties
Computed structural properties
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 114
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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