17-(4-Nonylphenoxy)-3,6,9,12,15-pentaoxaheptadecan-1-OL
Basic information
- CAS
34166-38-6- Standard SMILES
CCCCCCCCCc1ccc(OCCOCCOCCOCCOCCOCCO)cc1- InChIKey
CEWJCLBGTPZECP-UHFFFAOYSA-N- Molecular formula
- C27H48O7
- Average molar mass
- 484.7 g/mol
- Monoisotopic mass
- 484.34000387
Names & identifiers
- Preferred name
- 17-(4-Nonylphenoxy)-3,6,9,12,15-pentaoxaheptadecan-1-OL
- IUPAC
- 2-[2-[2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
- English name
- 2-[2-[2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
- Molecular formula
- C27H48O7
- Molecular weight
- 484.67
Names & synonyms
34166-38-62-[2-[2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol17-(4-NONYLPHENOXY)-3,6,9,12,15-PENTAOXAHEPTADECAN-1-OL3,6,9,12,15-Pentaoxaheptadecan-1-ol,17-(4-nonylphenoxy)-p-Nonylphenol hexaethoxylateNPEO6Nonylphenol-6-ethoxylate4-n-Nonylphenol hexaethoxylateSCHEMBL6930339DTXSID90858719DB-251104NS00076701
Show more names
4-nonylphenol hexaethoxylateNP6EO (Nonylphenol Hexaethoxylate)4-n-Nonylphenol hexaethoxylate in isooctane
3,6,9,12,15-Pentaoxaheptadecan-1-ol, 17-(4-nonylphenoxy)-
Database identifiers
- CAS
34166-38-6- PubChem CID
- 182170
- DTXSID
DTXSID90858719- Nikkaji
- J640.165A
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 26
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 389
Experimental & physicochemical properties
SurfactantsSurfactant -> linear alkylbenzyl sulfonate (LAS)
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 573.2 · 573.2±50.0 °C(Predicted)
- Density
- 1.025 · 1.025±0.06 g/cm3(Predicted)
- pka
- 14.36 · 14.36±0.10(Predicted)
- Substances of Very High Concern (SVHC) Candidate List
- 17 · 17-(4-nonylphenoxy)-3,6,9,12,15-pentaoxaheptadecan-1-ol (34166-38-6)
- EPA Substance Registry System
- 3 · 3,6,9,12,15-Pentaoxaheptadecan-1-ol, 17-(4-nonylphenoxy)- (34166-38-6)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationHazard Traits - Endocrine toxicity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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