Basic information
- CAS
488-40-4- Standard SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[O-]c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl- InChIKey
WWFIOGVBRROSQM-UHFFFAOYSA-M- Molecular formula
- C27H46Cl5NO
- Average molar mass
- 577.9 g/mol
- Monoisotopic mass
- 575.202204
Names & identifiers
- Preferred name
- Stearyltrimethylammonium pentachlorophenate
- IUPAC
- 2,3,4,5,6-pentachlorophenolate;trimethyl(octadecyl)azanium
- English name
- Octadecyltrimethylammonium pentachlorophenate
- Molecular formula
- C27H46Cl5NO
- Molecular weight
- 577.92
Names & synonyms
Stearyltrimethylammonium pentachlorophenateHyamine 3258OCTADECYLTRIMETHYLAMMONIUM PENTACHLOROPHENATE26F82J214N488-40-4Trimethyloctadecylammonium pentachlorophenoxideAmmonium, trimethyloctadecyl-, salt with pentachlorophenol (1:1)1-Octadecanaminium, N,N,N-trimethyl-, salt with pentachlorophenol (1:1)1-Octadecanaminium, N,N,N-trimethyl-, salt with 2,3,4,5,6-pentachlorophenol (1:1)UNII-26F82J214NQ27254089Octriphenate
Database identifiers
- CAS
488-40-4- PubChem CID
- 10265
- UNII
- 26F82J214N
Properties
Computed structural properties
- Topological polar surface area
- 23.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 17
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 354
Physicochemical properties
- FDA UNII
- 26 F82J214N · 26F82J214N
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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