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Details

Stereochemistry ACHIRAL
Molecular Formula C4H10O3
Molecular Weight 106.1204
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYLENE GLYCOL

SMILES

OCCOCCO

InChI

InChIKey=MTHSVFCYNBDYFN-UHFFFAOYSA-N
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

HIDE SMILES / InChI
Molecular Formula C4H10O3
Molecular Weight 106.1204
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

2009
359
PubMed

PubMed

TitleDatePubMed
Selection of potential therapeutics based on in vivo spatiotemporal transcription patterns of heme oxygenase-1.
2002 Oct
Structure determination of minor red pigment in carthamus red colorant isolated by preparative LC/MS.
2003 Nov
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Beta-substituted terthiophene [2]rotaxanes.
2009
Diglycolic acid is the nephrotoxic metabolite in diethylene glycol poisoning inducing necrosis in human proximal tubule cells in vitro.
2011 Nov
Role of tissue metabolite accumulation in the renal toxicity of diethylene glycol.
2011 Oct
Population-based in vitro hazard and concentration-response assessment of chemicals: the 1000 genomes high-throughput screening study.
2015 May
Patents

Patents

03983245
10
04018794
3
04062848
1
04212810
1
04435406
2
04551532
3
04613619
1
04617312
2
04620938
1
04626289
5
04808609
5
04829075
1
04906400
1
04985458
2
05093373
1
05118441
1
05182282
1
05290477
1
05302317
2
05319139
1
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:43:55 GMT 2023
Edited
by admin
on Fri Dec 15 17:43:55 GMT 2023
Record UNII
61BR964293
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYLENE GLYCOL
HSDB   INCI   MI   USP-RS  
INCI  
Official Name English
2,2-OXYDI(ETHAN-1-OL)
Systematic Name English
DIETHYLENE GLYCOL [INCI]
Common Name English
ETOFENAMATE IMPURITY F [EP IMPURITY]
Common Name English
NSC-36391
Code English
DIETHYLENE GLYCOL [MI]
Common Name English
2,2'-OXYDIETHANOL
Systematic Name English
DIETHYLENE GLYCOL ETHER
Common Name English
DIGLYCOL
Common Name English
PROPYLENE GLYCOL RELATED COMPOUND DIETHYLENE GLYCOL [USP IMPURITY]
Common Name English
DIETHYLENE GLYCOL [HSDB]
Common Name English
GLYCEROL IMPURITY A [EP IMPURITY]
Common Name English
2,2'-OXYBISETHANOL
Systematic Name English
DIETHYLENE GLYCOL [USP-RS]
Common Name English
ETHANOL, 2,2'-OXYBIS-
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 338200
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
Code System Code Type Description
EVMPD
SUB120568
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
MERCK INDEX
m4401
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY Merck Index
CAS
111-46-6
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID8020462
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
EVMPD
SUB13576MIG
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
RXCUI
1429928
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY RxNorm
RS_ITEM_NUM
1193265
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
CHEBI
46807
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-872-2
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
HSDB
69
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
SMS_ID
100000079556
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
MESH
C013484
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
PUBCHEM
8117
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
NSC
36391
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
WIKIPEDIA
DIETHYLENE GLYCOL
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
FDA UNII
61BR964293
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
DAILYMED
61BR964293
Created by admin on Fri Dec 15 17:43:55 GMT 2023 , Edited by admin on Fri Dec 15 17:43:55 GMT 2023
PRIMARY
Related Record Type Details
Structure of (2-HYDROXYETHOXY)ACETIC ACID
METABOLITE -> PARENT
Related Record Type Details
Structure of GLYCERIN
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (GC)
USP
Structure of ETOFENAMATE
PARENT -> IMPURITY
Structure of PROPYLENE GLYCOL
PARENT -> IMPURITY
NO peak value listed in USP
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
NIH
NCATS
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