3,6,9,12,15-Pentaoxahentriacontan-1-ol
Basic information
- CAS
4478-97-1- Standard SMILES
CCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCO- InChIKey
CJZQCJWPIYNMQG-UHFFFAOYSA-N- Molecular formula
- C26H54O6
- Average molar mass
- 462.7 g/mol
- Monoisotopic mass
- 462.39203944
Names & identifiers
- Preferred name
- 3,6,9,12,15-Pentaoxahentriacontan-1-ol
- IUPAC
- 2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
- English name
- Pentaethylene glycol monohexadecyl ether
- Molecular formula
- C26H54O6
- Molecular weight
- 462.7
Names & synonyms
4478-97-13,6,9,12,15-Pentaoxahentriacontan-1-olRefChem:487157Pentaethylene glycol monohexadecyl ether2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanolPENTAETHYLENEGLYCOLMONOHEXADECYLETHERHexadecylpentaglycolC16E5SCHEMBL60628DTXSID80398932CJZQCJWPIYNMQG-UHFFFAOYSA-NC26H54O6
Show more names
CETETH-5polyoxyethylene 5 cetyl etherceteth-5,polyoxyethylene-5cetyletherHEXADECYL PENTAETHYLENE GLYCOL ETHERPENTAETHYLENE GLYCOL MONOHEXADECYL ETHER 99+%
penta-ethyleneglycol hexadecyl etherMFCD00043365NS00076700F88025F863621Pentaethylene glycol monohexadecyl ether, BioXtra, >=99.0% (TLC)
Database identifiers
- CAS
4478-97-1- PubChem CID
- 4064324
- DTXSID
DTXSID80398932- Nikkaji
- J730.881G
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 29
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 317
Physicochemical properties
- Melting point
- 39 · 39-40 °C
- Boiling point
- 233 · 233-234 °C(Press: 0.3 Torr)
- Density
- 0.95 · 0.950±0.06 g/cm3(Predicted)
- pka
- 14.36 · 14.36±0.10(Predicted)
- Cosmetics Ingredients Functions
- SURFACTANT - EMULSIFYINGSURFACTANT - CLEANSING
- Cosmetic Ingredient Review (CIR)
- PENTAETHYLENE GLYCOL MONOHEXADECYL ETHER (4478-97-1)
- LogP
- 5.74 · 5.740 (est)
- EWG's Food Scores
- 1 · 1-2
- FDA UNII
- 8 K9HXI96S · G8K9HXI96S
- EPA Substance Registry System
- 3 · 3,6,9,12,15-Pentaoxahentriacontan-1-ol (4478-97-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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 Information3,6,9,12,15-Pentaoxahentriacontan-1-ol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- F
- 10-23
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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