2-((2-Methylphenyl)dithio)ethanamine
Basic information
- CAS
5301-11-1- Standard SMILES
Cc1ccccc1SSCCN- InChIKey
XQXLXURYLSFILY-UHFFFAOYSA-N- Molecular formula
- C9H13NS2
- Average molar mass
- 199.3 g/mol
- Monoisotopic mass
- 199.04894177
Names & identifiers
- Preferred name
- 2-((2-Methylphenyl)dithio)ethanamine
- IUPAC
- 2-[(2-methylphenyl)disulfanyl]ethanamine
Names & synonyms
2-((2-Methylphenyl)dithio)ethanamineNSC 342020NSC3420205301-11-12-(o-tolyldisulfanyl)ethanamine2-((2-Methylphenyl)dithio)ethylamine
Database identifiers
- CAS
5301-11-1- PubChem CID
- 434076
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 76.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 119
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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