Basic information
- CAS
18129-31-2- Standard SMILES
C[N+](C)(C)CCSC(N)=[NH2+].[Br-].[Br-]- InChIKey
DRCFNKMWMBPEJV-UHFFFAOYSA-M- Molecular formula
- C6H17Br2N3S
- Average molar mass
- 323.1 g/mol
- Monoisotopic mass
- 320.95099
Names & identifiers
- Preferred name
- Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide
- IUPAC
- 2-[amino(azaniumylidene)methyl]sulfanylethyl-trimethylazanium dibromide
Names & synonyms
18129-31-2AMMONIUM, (2-(AMIDINOTHIO)ETHYL)TRIMETHYL-, BROMIDE, MONOHYDROBROMIDERefChem:1076707(2-(Amidinothio)ethyl)trimethylammonium bromide hydrobromide2-Trimethylaminoethylisothiuronium bromide hydrobromideEthanaminium, 2-((aminoiminomethyl)thio)-N,N,N-trimethyl-, bromide, monohydrobromide
Database identifiers
- CAS
18129-31-2- PubChem CID
- 28898
Properties
Computed structural properties
- Topological polar surface area
- 76.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 111
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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