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Bis(2-ethylhexyl) Phosphate-d34

CAT: 0572-TRC-B433867-2.5MGSize: 2.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-B433867-2.5MGSize:2.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1773493-20-1
Synonyms
2-Ethyl-1-hexanol Hydrogen Phosphate-d34; 2-Ethyl-1-hexanol Hydrogen Phosphate A 208-d34; A 208 (phosphate)-d34; Baysolvex D 2EHPA-d34; Bis(2-ethylhexyl) Hydrogen Phosphate-d34; Bis(2-ethylhexyl) Orthophosphate-d34; Bis(2-ethylhexyl) phosphate-d34; D 2EHPA-d34; DEHAP-d34; DP 8-d34; DP 8R-d34; Di(2-ethylhexyl) Phosphate-d34; Di(2-ethylhexyl)orthophosphoric Acid-d34; Di(2-ethylhexyl)phosphoric Acid-d34; Di-2-ethylhexyl Hydrogen Phosphate-d34; Dioctyl Hydrogen Phosphate-d34; Dioctyl Orthophosphate-d34; Dioctyl Phosphate-d34; HDEHP-d34; HDEHPA-d34; Hostarex PA 216-d34; Hydrogen Bis(2-ethylhexyl) Phosphate-d34; JB 58-d34; LB 58-d34; O,O-Bis(2-ethylhexyl)phosphoric Acid-d34; O,O-Di(2-ethylhexyl)phosphoric Acid-d34; Orthophosphoric Acid 2-Ethylhexyl Alcohol Diester-d34; P 204-d34; P 204 (acid)-d34; Phoslex A 208-d34; Phosphoric Acid di(2-ethylhexyl)Ester-d34; TOPS 99-d34
Hazard Statement
Harmful in contact with skin; UN number: UN1902; Packing Group: III
Purity
>95% (HPLC)
Smiles
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])(C([2H])([2H])OP(=O)([O-])OC([2H])([2H])C([2H])(C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])[2H]
Molecular Formula
C16 D34 O4 P
Molecular Weight
355.622
InChI
InChI=1S/C16H35O4P/c1-5-9-11-15(7-3)13-19-21(17,18)20-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3,(H,17,18)/p-1/i1D3,2D3,3D3,4D3,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D,16D
Additionnal Information
IUPAC name: bis[1,1,2,3,3,4,4,5,5,6,6,6-dodecadeuterio-2-(1,1,2,2,2-pentadeuterioethyl)hexyl] phosphate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Bis(2-ethylhexyl) Phosphate-d34
CAS Number1773493-20-1
PubChem CID169434633
IUPAC Namebis[1,1,2,3,3,4,4,5,5,6,6,6-dodecadeuterio-2-(1,1,2,2,2-pentadeuterioethyl)hexyl] phosphate
Molecular FormulaC16H34O4P-
Molecular Weight355.62
XLogP5.2
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Heavy Atom Count21
Formal Charge-1
Complexity251
SMILES
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])(C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])OP(=O)([O-])OC([2H])([2H])C([2H])(C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
InChI
InChI=1S/C16H35O4P/c1-5-9-11-15(7-3)13-19-21(17,18)20-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3,(H,17,18)/p-1/i1D3,2D3,3D3,4D3,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D,16D
InChIKey
SEGLCEQVOFDUPX-RFETUZSTSA-M
Chemical Structure
2D Structure
2D structure of Bis(2-ethylhexyl) Phosphate-d34
CAS: 1773493-20-1
CID: 169434633
Formula: C16H34O4P-
MW: 355.62
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight355.62
XLogP35.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Exact Mass355.43288092
Monoisotopic Mass355.43288092
Topological Polar Surface Area58.6 Ų
Heavy Atom Count21
Formal Charge-1
Complexity251
Isotope Atom Count34
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
442807-01Bis (2-ethylhexyl) Phosphate-d34 discontinued
442805-01Bis (2-ethylhexyl) Azelate-d34
AR-O01056-01Dibutyltin bis (2-ethylhexyl mercaptoacetate) -d34
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10092482-100gBis (2-ethylhexyl) hydrogen phosphate
RAA36897-01Bis (2-ethylhexyl) phenyl phosphate
IN-0036-HP-BULKTrihexyltetradecylphosphonium bis (2-ethylhexyl) phosphate
sc-235277Hemi-Calcium bis (2-ethylhexyl) phosphate
410892-011,2,4-Benzenetricarboxylic Acid 1,2-Bis (2-ethylhexyl) Ester-d34
410894-011,2,4-Benzenetricarboxylic Acid 1,4-Bis (2-ethylhexyl) Ester-d34

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