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Details

Stereochemistry ACHIRAL
Molecular Formula C4H10N2O3
Molecular Weight 134.1338
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-NITROSODIETHANOLAMINE

SMILES

OCCN(CCO)N=O

InChI

InChIKey=YFCDLVPYFMHRQZ-UHFFFAOYSA-N
InChI=1S/C4H10N2O3/c7-3-1-6(5-9)2-4-8/h7-8H,1-4H2

HIDE SMILES / InChI

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Mutagenicity of N-nitrosodiethanolamine in a V79-derived cell line expressing two human biotransformation enzymes.
2008 Aug 25
Patents

Patents

20070186940
1
Name Type Language
N-NITROSODIETHANOLAMINE
HSDB   MI  
Systematic Name English
TROLAMINE IMPURITY C [EP IMPURITY]
Common Name English
2,2'-NITROSIMINODIETHANOL
Common Name English
2,2'-(NITROSOIMINO)BISETHANOL
Systematic Name English
N-NITROSODIETHANOLAMINE [HSDB]
Common Name English
NCI-C55583
Code English
N-NITROSODIETHANOLAMINE [MI]
Common Name English
DI-(2-HYDROXYETHYL)NITROSAMINE
Common Name English
N-NITROSODIETHANOLAMINE [IARC]
Common Name English
DIETHANOLNITROSAMINE
Common Name English
NDELA
Common Name English
ETHANOL, 2,2'-(NITROSOIMINO)BIS-
Systematic Name English
NITROSODIETHANOLAMINE, N-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C45398
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
214-237-4
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
FDA UNII
30YI1289VY
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
HSDB
4180
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
PUBCHEM
14223
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
MESH
C014129
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
CAS
1116-54-7
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
NCI_THESAURUS
C44416
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID7021027
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY
MERCK INDEX
m7992
Created by admin on Fri Dec 15 17:08:59 GMT 2023 , Edited by admin on Fri Dec 15 17:08:59 GMT 2023
PRIMARY Merck Index
NIH
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