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Details

Stereochemistry ACHIRAL
Molecular Formula C13H30O6P2
Molecular Weight 344.3212
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TETRAISOPROPYL METHYLENEDIPHOSPHONATE

SMILES

CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C

InChI

InChIKey=ODTQUKVFOLFLIQ-UHFFFAOYSA-N
InChI=1S/C13H30O6P2/c1-10(2)16-20(14,17-11(3)4)9-21(15,18-12(5)6)19-13(7)8/h10-13H,9H2,1-8H3

HIDE SMILES / InChI

Molecular Formula C13H30O6P2
Molecular Weight 344.3212
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Tetraisopropyl methylenediphosphonate used in the synthesis of unsaturated phosphonocholines with enantioselective effects on neuronal tumor cell proliferation and viability. Also is used in the preparation of E2-bisphosphonate conjugates as potential anti-osteoporosis agents and in the preparation of AZT 5’-Triphosphate compounds, which display inhibitory effects on HIV-1 reverse transcriptase.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Synthesis and use of novel ether phospholipid enantiomers to probe the molecular basis of the antitumor Effects of alkyllysophospholipids: correlation of differential activation of c-Jun NH(2)-terminal protein kinase with antiproliferative effects in neuronal tumor cells.
2004 May 6
Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:50:39 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:39 GMT 2023
Record UNII
K46Y5V9U61
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TETRAISOPROPYL METHYLENEDIPHOSPHONATE
Systematic Name English
METHYLENEDIPHOSPHONIC ACID TETRAISOPROPYL ESTER
Systematic Name English
PHOSPHONIC ACID, METHYLENEDI-, TETRAISOPROPYL ESTER
Systematic Name English
((DIISOPROPOXYPHOSPHINYL)METHYL)DIISOPROPOXYPHOSPHINE OXIDE
Systematic Name English
TETRAISOPROPYL METHYLENEBISPHOSPHONATE
Systematic Name English
NSC-226577
Code English
PHOSPHONIC ACID, P,P'-METHYLENEBIS-, P,P,P',P'-TETRAKIS(1-METHYLETHYL) ESTER
Systematic Name English
PHOSPHONIC ACID, METHYLENEBIS-, TETRAKIS(1-METHYLETHYL) ESTER
Systematic Name English
TETRAKIS(O-ISOPROPYL) METHYLENEDIPHOSPHONATE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
216-765-0
Created by admin on Sat Dec 16 08:50:39 GMT 2023 , Edited by admin on Sat Dec 16 08:50:39 GMT 2023
PRIMARY
NSC
226577
Created by admin on Sat Dec 16 08:50:39 GMT 2023 , Edited by admin on Sat Dec 16 08:50:39 GMT 2023
PRIMARY
FDA UNII
K46Y5V9U61
Created by admin on Sat Dec 16 08:50:39 GMT 2023 , Edited by admin on Sat Dec 16 08:50:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID7044847
Created by admin on Sat Dec 16 08:50:39 GMT 2023 , Edited by admin on Sat Dec 16 08:50:39 GMT 2023
PRIMARY
CAS
1660-95-3
Created by admin on Sat Dec 16 08:50:39 GMT 2023 , Edited by admin on Sat Dec 16 08:50:39 GMT 2023
PRIMARY
PUBCHEM
74266
Created by admin on Sat Dec 16 08:50:39 GMT 2023 , Edited by admin on Sat Dec 16 08:50:39 GMT 2023
PRIMARY