Tris(2-butoxyethyl) phosphate
Product Information
Molecular Formula
C18H39O7P
Molecular Weight
398.47
Description
Tris(2-butoxyethyl) phosphate (CAS# 78-51-3) is a useful research chemical.
Synonyms
tris(2-butoxyethyl) phosphate
IUPAC Name
tris(2-butoxyethyl) phosphate
SMILES
CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC
InChI
InChI=1S/C18H39O7P/c1-4-7-10-20-13-16-23-26(19,24-17-14-21-11-8-5-2)25-18-15-22-12-9-6-3/h4-18H2,1-3H3
InChI Key
WTLBZVNBAKMVDP-UHFFFAOYSA-N
Boiling Point
215-228 °C (4 mmHg)
Melting Point
-70 °C
Flash Point
210 °C
Purity
95 %
Density
1.006 g/cm3
Solubility
Soluble
Appearance
Viscous colourless or slightly yellow liquid
Application
Used as a plasticizer for resins and elastomers, in floor finishes and waxes, as a flame retardant, as a plasticizer for rubber stoppers in blood specimen containers, and as a fire-resistant and light-stable plasticizer for products intended for food contact; Occupational exposure is likely to be by skin absorption during production and from floor polishes; Used as solvent for resins, a viscosity modifier in plastisols, and an antifoam agent for synthetic rubber, plastics, and lacquers.
Storage
Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Refractive Index
1.44
Stability
Stable under recommended storage conditions
LogP
4.59440
Vapor Pressure
0.03 mmHg at 302 °F
Henry's Law Constant
1.2X10-11 atm-cu m/mol at 25 °C (est)
Decomposition
When heated to decomposition it emits toxic fumes of /phosphorous oxides/
Odor
SWEETISH
Safety Information
Hazards
H319:
Causes serious eye irritation.
Causes serious eye irritation.
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
2.8
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
21
Exact Mass
398.24334058 g/mol
Monoisotopic Mass
398.24334058 g/mol
Topological Polar Surface Area
72.4Ų
Heavy Atom Count
26
Formal Charge
0
Complexity
281
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| JP-2022033277-A | Adhesive for unvulcanized rubber and adhesive for unvulcanized rubber Water dispersion | 2022-01-05 |
| CN-113970609-A | LC-MS/MS analysis method for sediment organic phosphate and metabolite | 2021-11-02 |
| CN-113717677-A | Double-component polyurethane adhesive and preparation method thereof | 2021-08-24 |
| CN-113686839-A | Method for synchronously evaluating removal and toxicity reduction of organic phosphate in sewage aerobic process | 2021-08-23 |
| CN-113583325-A | Processing method of low-temperature-resistant modified plastic | 2021-08-05 |
| CN-113671068-A | Method for analyzing environmental pollutant targeting exposure component in blood plasma and application thereof | 2021-07-27 |
| KR-102340373-B1 | Flame retardant epoxy composition | 2021-07-27 |
| CN-113372869-A | Double-component yellowing-resistant flame-retardant polyurethane electronic pouring sealant and preparation method thereof | 2021-07-19 |
| CN-113527613-A | Synthesis process of polyurethane elastomer and preparation process of microporous foam material | 2021-06-17 |
| AU-2021103279-A4 | A process for isolation and yield increase of flavonoid compound/quercetin from plant houttuynia cordata thunb by uv-b exposure | 2021-04-16 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 33367866 | 2021-02-26 | Effects of an Environmentally Relevant Mixture of Organophosphate Esters Derived From House Dust on Endochondral Ossification in Murine Limb Bud Cultures | Toxicological sciences : an official journal of the Society of Toxicology |
| 30966736 | 2019-06-17 | Organophosphorus Flame Retardants Impair Intracellular Lipid Metabolic Function in Human Hepatocellular Cells | Chemical research in toxicology |
| 30974155 | 2019-05-15 | Biotransformation and oxidative stress responses in rat hepatic cell-line (H4IIE) exposed to organophosphate esters (OPEs) | Toxicology and applied pharmacology |
| 30176492 | 2019-02-01 | Global microRNA and isomiR expression associated with liver metabolism is induced by organophosphorus flame retardant exposure in male Chinese rare minnow (Gobiocypris rarus) | The Science of the total environment |
| 30149310 | 2018-12-01 | Effects of environmentally relevant concentrations of tris (2-butoxyethyl) phosphate on growth and transcription of genes involved in the GH/IGF and HPT axes in zebrafish (Danio rerio) | Chemosphere |
| 29024780 | 2018-02-01 | Toxicogenomics of the flame retardant tris (2-butoxyethyl) phosphate in HepG2 cells using RNA-seq | Toxicology in vitro : an international journal published in association with BIBRA |
| 28772162 | 2017-10-01 | Acute exposure to tris (2-butoxyethyl) phosphate (TBOEP) affects growth and development of embryo-larval zebrafish | Aquatic toxicology (Amsterdam, Netherlands) |
| 28711770 | 2017-09-01 | Multigenerational effects evaluation of the flame retardant tris(2-butoxyethyl) phosphate (TBOEP) using Daphnia magna | Aquatic toxicology (Amsterdam, Netherlands) |
| 27912163 | 2017-01-01 | Reproduction impairment and endocrine disruption in adult zebrafish (Danio rerio) after waterborne exposure to TBOEP | Aquatic toxicology (Amsterdam, Netherlands) |
| 27146889 | 2016-12-01 | Developmental neurotoxicity of organophosphate flame retardants in early life stages of Japanese medaka (Oryzias latipes) | Environmental toxicology and chemistry |
