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Diethyl Phosphate Sodium Salt

CAT: 0572-TRC-D444720-2.5GSize: 2.5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D444720-2.5GSize:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2870-30-6
Synonyms
Phosphoric Acid Diethyl Ester Sodium Salt; Ethyl Sodium Phosphate; Diethyl Sodium Phosphate; Sodium Diethyl Phosphate;
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
CCOP(=O)([O-])OCC.[Na+]
Molecular Formula
C4H10NaO4P
Molecular Weight
176.08
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Phosphoric acid, diethyl ester, sodium salt (1:1)
CAS Number2870-30-6
PubChem CID23668382
IUPAC Namesodium diethyl phosphate
Molecular FormulaC4H10NaO4P
Molecular Weight176.08
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count10
Formal Charge0
Complexity108
SMILES
CCOP(=O)([O-])OCC.[Na+]
InChI
InChI=1S/C4H11O4P.Na/c1-3-7-9(5,6)8-4-2;/h3-4H2,1-2H3,(H,5,6);/q;+1/p-1
InChIKey
GUCVHDYRKMSBOJ-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Phosphoric acid, diethyl ester, sodium salt (1:1)
CAS: 2870-30-6
CID: 23668382
Formula: C4H10NaO4P
MW: 176.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight176.08
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass176.02144008
Monoisotopic Mass176.02144008
Topological Polar Surface Area58.6 Ų
Heavy Atom Count10
Formal Charge0
Complexity108
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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