Synonyms
I14-11686; AN-42105; AC1L1MR7; Tris-(2-butoxyethyl)fosfat [Czech]; KSC377C2F; NCGC00259142-01; UNII-RYA6940G86; 2-Butoxyethanol phosphate; SCHEMBL37268; Phosphoric acid, tri-(2-butoxyethyl) ester;
IUPAC Name
tris(2-butoxyethyl) phosphate;
Molecular Weight
398.477g/mol
Molecular Formula
C18H39O7P;
Canonical 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;
Melting Point
-94 ° F (NTP, 1992);-70.0°C;-70 deg C;
Density
1.02 at 68 ° F (NTP, 1992);1.02 g/cu cm at 20 deg C;
Solubility
Soluble (NTP, 1992);0.00 M;In water, 1,100 mg/L at 25 deg C;SOL IN MINERAL OILS & MOST ORG LIQ;Insoluble or limited solubility in glycerol, glycols, certain amines; soluble in most organic liquids;
Color Form
Liquid;Light-colored liquid;Slightly yellow, oily liquid;
Complexity
281
Covalently-Bonded Unit Count
1
Decomposition
When heated to decomposition it emits toxic fumes of /phosphorous oxides/;
EC Number
201-122-9
Exact Mass
398.243g/mol
H-Bond Acceptor
7
Heavy Atom Count
26
Monoisotopic Mass
398.243g/mol
NSC Number
62228
Odor
SWEETISH;Butyl-like;
Other Experimental
BP: 215-228 deg C at 4 mm Hg;BP: 200-230 deg C at 4 mm Hg;BP: 255 deg C at 10 mm Hg;VP: 0.03 mm Hg at 150 deg C;Henry's Law constant = 1.2X10-11 atm-cu m/mol at 25 deg C (est);Hydroxyl radical reaction rate constant = 1.2X10-10 cu cm/molec-sec at 25 deg C (est);
Rotatable Bond Count
21
Stability
Stable under recommended storage conditions.;
Topological Polar Surface Area
72.4A^2
UNII
RYA6940G86
Vapor Pressure
0.03 mm Hg at 302 ° F (NTP, 1992);1.2X10-6 mm Hg at 25 deg C;
