Diethyl phosphate

Details

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Internal ID 44f0b59d-40ab-42d9-8497-8d96eaff9c26
Taxonomy Organic acids and derivatives > Organic phosphoric acids and derivatives > Phosphate esters > Alkyl phosphates > Dialkyl phosphates
IUPAC Name diethyl hydrogen phosphate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6)
InChI Key UCQFCFPECQILOL-UHFFFAOYSA-N
Popularity 372 references in papers

Physical and Chemical Properties

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Molecular Formula C4H11O4P
Molecular Weight 154.10 g/mol
Exact Mass 154.03949583 g/mol
Topological Polar Surface Area (TPSA) 55.80 Ų
XlogP -0.30

Synonyms

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Diethyl phosphate
598-02-7
Diethyl acid phosphate
phosphoric acid, diethyl ester
diethyl phosphoric acid
Diethylphosphoric acid
diethoxyphosphinic acid
Ethyl phosphate, di-
O,O-Diethyl hydrogen phosphate
Ethyl phosphate, (ETO)2(HO)PO
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Diethyl phosphate

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 91.71% 96.09%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 90.90% 97.29%
CHEMBL4040 P28482 MAP kinase ERK2 87.80% 83.82%
CHEMBL3401 O75469 Pregnane X receptor 84.41% 94.73%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 83.88% 96.95%
CHEMBL3230 O95977 Sphingosine 1-phosphate receptor Edg-6 82.75% 94.01%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 654
LOTUS LTS0074827
wikiData Q26841026