(3-(1H-IMIDAZOL-5-YL)-2-OXIDANYLIDENE-PROPYL) DIHYDROGEN PHOSPHATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H9N2O5P
Molecular Weight	220.1198
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (3-(1H-IMIDAZOL-5-YL)-2-OXIDANYLIDENE-PROPYL) DIHYDROGEN PHOSPHATE

Structure Search

SMILES

OP(O)(=O)OCC(=O)CC1=CN=CN1

InChI

InChIKey=YCFFMSOLUMRAMD-UHFFFAOYSA-N

InChI=1S/C6H9N2O5P/c9-6(3-13-14(10,11)12)1-5-2-7-4-8-5/h2,4H,1,3H2,(H,7,8)(H2,10,11,12)

HIDE SMILES / InChI

Molecular Formula	C6H9N2O5P
Molecular Weight	220.1198
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 05:26:50 GMT 2025` Edited by `admin` on `Wed Apr 02 05:26:50 GMT 2025`
Record UNII	VSR6VJ2DT6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(3-(1H-IMIDAZOL-5-YL)-2-OXIDANYLIDENE-PROPYL) DIHYDROGEN PHOSPHATE

Systematic Name

English

1-(1H-Imidazol-5-yl)-3-(phosphonooxy)-2-propanone

Preferred Name

English

[3-(3H-imidazol-4-yl)-2-oxopropyl] dihydrogen phosphate

Systematic Name

English

2-Propanone, 1-(1H-imidazol-5-yl)-3-(phosphonooxy)-

Systematic Name

English

3-(Imidazol-4-yl)-2-oxopropyl phosphate

Systematic Name

English

2-Propanone, 1-hydroxy-3-(imidazol-4-yl)-, 1-phosphate

Systematic Name

English

Code System Code Type Description

FDA UNII

VSR6VJ2DT6

Created by admin on Wed Apr 02 05:26:50 GMT 2025 , Edited by admin on Wed Apr 02 05:26:50 GMT 2025

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PUBCHEM

792

Created by admin on Wed Apr 02 05:26:50 GMT 2025 , Edited by admin on Wed Apr 02 05:26:50 GMT 2025

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CAS

99979-59-6

Created by admin on Wed Apr 02 05:26:50 GMT 2025 , Edited by admin on Wed Apr 02 05:26:50 GMT 2025

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EPA CompTox

DTXSID50912361

Created by admin on Wed Apr 02 05:26:50 GMT 2025 , Edited by admin on Wed Apr 02 05:26:50 GMT 2025

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