Home Other Heterocycles 1005-93-2
1005-93-2,MFCD00043597
Catalog No.:AA00023U
1005-93-2 | 2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-ethyl-, 1-oxide
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Technical Information
Catalog Number:
AA00023U
Chemical Name:
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-ethyl-, 1-oxide
CAS Number:
1005-93-2
Molecular Formula:
C6H11O4P
Molecular Weight:
178.1229
MDL Number:
MFCD00043597
IUPAC Name:
4-ethyl-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
InChI:
InChI=1S/C6H11O4P/c1-2-6-3-8-11(7,9-4-6)10-5-6/h2-5H2,1H3
InChI Key:
BYEFHDZWRALTEN-UHFFFAOYSA-N
SMILES:
CCC12COP(=O)(OC1)OC2
EC Number:
213-740-6
NSC Number:
72890
Properties
Computed Properties
 
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.039g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.124g/mol
Monoisotopic Mass:
178.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

Synonyms
 
4-ethyl-1-phospha-2,6,7 trioxabicyclo(2.2.2)octane-1-oxide 
4-ethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2.)octane-1-oxide 
Trimethyolpropane phosphate 
TRIMETHYLOLPROPANE PHOSPHATE 
Etbicuphat 
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-ethyl-, 1-oxide 
EINECS 213-740-6 
2-(Hydroxymethyl)-2-ethyl-1,3-propanediol, cyclic phosphate (1:1) 
2-Ethyl-2-(hydroxymethyl)-1,3-propanediol, cyclic phosphate (1:1) 
BRN 1909748 
4-Ethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane-1-oxide 
4-Ethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-oxide 
TMPP (phosphate) 
1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, cyclic phosphate 
1-Ethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane 1-oxide 
1-Ethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane-1-oxide 
4-Aethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octan-1-oxid 
4-Ethyl-1-phospha-2,6,7 trioxabicyclo(2.2.2)octane-1-oxide 
4-Ethyl-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane-1-oxide 
4-Aethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octan-1-oxid [German] 
4-Ethyl-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane 1-oxide 
2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-ethyl-, 1-oxide 
2,6,7-Trioxa-1-phosphabicyclo-[2.2.2]octane, 4-ethyl-, 1-oxide 
TMPP-oxide 
2,6,7-Trioxa-1-phosphabicyclo-(2.2.2)octane, 4-ethyl-, 1-oxide 
TMPP-oxide 
TMPP (phosphate) 
AC1L22NN 
SCHEMBL813272 
4-ethyl-2,6,7-trioxa-1 
DTXSID5058270 
CTK8F9511 
BYEFHDZWRALTEN-UHFFFAOYSA-N 
NSC72890 
trimethylolpropane phosphate 
ZINC1698775 
Etbicyphat, >=95% (NMR), solid 
FCH837982 
MFCD00043597 
NSC-72890 
SBB008287 
AKOS006272342 
FR-1172 
WLN: T4PTJ AO BQ C2Q C1 DQ 
LS-120406 
1005-93-2 
E-175 
FT-0626165 
1, 2-ethyl-2-(hydroxymethyl)-, cyclic phosphate 
C-49006 
J-000170 
3-propanediol,2-ethyl-2-(hydroxymethyl)-cyclicphosphate 
1, 2-ethyl-2-(hydroxymethyl)-, cyclic phosphate (1:1) 
4-Aethyl-1-phospha-2,7-trioxabicyclo[2.2.2]octan 1-oxid 
4-ethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octan-1-one 
4-ethyl-1-phospha-2,6,7-trioxabicyclo(2.2.2.)octane-1-oxide 
ETBICYPHAT 
4-Ethyl-1-phospha-2,7-trioxabicyclo[2.2.2]octane 1-oxide 
4-Ethyl-2,6,7-trioxa-1-phospha(V)bicyclo[2.2.2]octan-1-one 
4-ethyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane 1-oxide 
4-ethyl-2,6,7-trioxa-1-phosphabicy-clo[2.2.2]octane 1-oxide 
4-Ethyl-2,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-oxide 
2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane,4-ethyl-, 1-oxide 
2,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-ethyl-, 1-oxide 
2-(hydroxymethyl)-2-ethyl-1,3-propanediol,cyclicphosphate(1:1) 
2-Ethyl-2-(hydroxymethyl)-1,3-propanediol cyclic phosphate (1:1) 
2-ethyl-2-(hydroxymethyl)-1,3-propanediol,cyclicphosphate(1:1) 
Ethyl bicyclic phosphate 
4-ethyl-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octan-1-one 
4-Ethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-oxide. 
4-ethyl-2,6,7-trioxa-1?^{5}-phosphabicyclo[2.2.2]octane 1-oxide 
2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-ethyl-, 1-oxide (9CI) 
1,1,1-Trimethylolpropane Phosphate 
C6H11O4P 
C6H13O4P 
C6-H11-O4-P 
CID13869 
1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, cyclic phosphate (1:1) 
TMP-P 
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane,4-ethyl-,1-oxide 
3-propanediol,2-ethyl-2-(hydroxymethyl)-cyclicphosphateEtbicyphat 
Trimethylopropane phosphate 
Literature

Title: 1,2-Dibromo-4-(1,2-dibromoethyl)-cyclohexane and tris(methylphenyl) phosphate cause significant effects on development, mRNA expression, and circulating bile acid concentrations in chicken embryos.

Journal: Toxicology and applied pharmacology 20140615

Title: Derivatisation of carboxylic acid groups in pharmaceuticals for enhanced detection using liquid chromatography with electrospray ionisation tandem mass spectrometry.

Journal: Rapid communications in mass spectrometry : RCM 20050101

Title: Gene modulation in total brain induced by exposure to the bicyclic phosphorus ester trimethylolpropane phosphate (TMPP).

Journal: Neurotoxicology 20020701

Title: The use of GABA(A) receptors expressed in neural precursor cells for cell-based assays.

Journal: Biosensors & bioelectronics 20010901

Title: Characterization of acute neurotoxic effects of trimethylolpropane phosphate via neuronal network biosensors.

Journal: Biosensors & bioelectronics 20010901

Title: Identification of differential gene expression profiles in rat cortical cells exposed to the neuroactive agents trimethylolpropane phosphate and bicuculline.

Journal: Biosensors & bioelectronics 20010901

Title: Reduction of motor seizures in rats induced by the ethyl bicyclophosphate trimethylolpropane phosphate (TMPP).

Journal: Progress in neuro-psychopharmacology & biological psychiatry 20010801

Title: Behavioral sensitization following exposure to low doses of trimethylolpropane phosphate.

Journal: The Science of the total environment 20010702

Title: Trimethylolpropane phosphate induces epileptiform discharges in the CA1 region of the rat hippocampus.

Journal: Toxicology and applied pharmacology 20010301

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