Basic information
- CAS
38920-67-1- Standard SMILES
Cc1ccccc1OCCCCCNCCS.Cl- InChIKey
HDEDKRHBZZCKTC-UHFFFAOYSA-N- Molecular formula
- C14H24ClNOS
- Average molar mass
- 289.9 g/mol
- Monoisotopic mass
- 289.1267133
Names & identifiers
- Preferred name
- Ethanethiol, 2-((5-(o-tolyloxy)pentyl)amino)-, hydrochloride
- IUPAC
- 2-[5-(2-methylphenoxy)pentylamino]ethanethiol;hydrochloride
- English name
- Ethanethiol, 2-((5-(o-tolyloxy)pentyl)amino)-, hydrochloride
- Molecular formula
- C14H24ClNOS
- Molecular weight
- 0
Names & synonyms
38920-67-1Ethanethiol, 2-((5-(o-tolyloxy)pentyl)amino)-, hydrochloride2-((5-(o-Tolyloxy)pentyl)amino)ethanethiol hydrochlorideDTXSID90192201RefChem:340310DTXCID601146922-{[5-(2-Methylphenoxy)pentyl]amino}ethane-1-thiol--hydrogen chloride (1/1)
Database identifiers
- CAS
38920-67-1- PubChem CID
- 217538
- DTXSID
DTXSID90192201
Properties
Computed structural properties
- Topological polar surface area
- 22.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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