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Diethyl phosphate-d10 (diethyl-d10)

CAT: 0572-TRC-P359432-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-P359432-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2483831-48-5
Synonyms
Ethan-1,1,2,2,2-d5-ol, 1,1'-(hydrogen phosphate) (ACI); Ethan-1,1,2,2,2-d5-ol 1,1'-(hydrogen phosphate); Diethyl-d10 Phosphate; Diethyl Phosphate-d10; Diethyl Phosphate-D10
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
[2H]C([2H])([2H])C([2H])([2H])OP(=O)(O)OC([2H])([2H])C([2H])([2H])[2H]
Molecular Formula
C4 D10 H O4 P
Molecular Weight
164.1631
InChI
InChI=1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6)/i1D3,2D3,3D2,4D2
Additionnal Information
IUPAC name: bis(1,1,2,2,2-pentadeuterioethyl) hydrogen phosphate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Diethyl-D10 phosphate
CAS Number2483831-48-5
PubChem CID139025333
IUPAC Namebis(1,1,2,2,2-pentadeuterioethyl) hydrogen phosphate
Molecular FormulaC4H11O4P
Molecular Weight164.16
XLogP-0.3
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity103
SMILES
[2H]C([2H])([2H])C([2H])([2H])OP(=O)(O)OC([2H])([2H])C([2H])([2H])[2H]
InChI
InChI=1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6)/i1D3,2D3,3D2,4D2
InChIKey
UCQFCFPECQILOL-MWUKXHIBSA-N
Chemical Structure
2D Structure
2D structure of Diethyl-D10 phosphate
CAS: 2483831-48-5
CID: 139025333
Formula: C4H11O4P
MW: 164.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight164.16
XLogP3-0.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass164.10226329
Monoisotopic Mass164.10226329
Topological Polar Surface Area55.8 Ų
Heavy Atom Count9
Formal Charge0
Complexity103
Isotope Atom Count10
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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AR-C02536-01Diethyl hydrogen phosphate-D10
HY-101417S1-01Diethyl phosphate-d10-1
FD180613-01Diethyl sulfate-d10
CS-T-95613Malathion (Diethyl-d10)
KLA13288-01Diethyl-d10-amine
TMIJ-0447-01Chlorpyrifos (diethyl-d10)
sc-211319Diethyl Chlorothiophosphate-d10
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