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Details

Stereochemistry ACHIRAL
Molecular Formula C12H19N3O2
Molecular Weight 237.2982
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANILINE, N-(2-(DIETHYLAMINO)ETHYL)-2-NITRO-

SMILES

CCN(CC)CCNC1=CC=CC=C1[N+]([O-])=O

InChI

InChIKey=PTAKFIZKSZZSBU-UHFFFAOYSA-N
InChI=1S/C12H19N3O2/c1-3-14(4-2)10-9-13-11-7-5-6-8-12(11)15(16)17/h5-8,13H,3-4,9-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H19N3O2
Molecular Weight 237.2982
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 Tue Apr 01 19:59:49 GMT 2025
Edited
by admin
on Tue Apr 01 19:59:49 GMT 2025
Record UNII
52UHH5Z5EM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-135988
Preferred Name English
ANILINE, N-(2-(DIETHYLAMINO)ETHYL)-2-NITRO-
Systematic Name English
N1,N1-DIETHYL-N2-(2-NITROPHENYL)-1,2-ETHANEDIAMINE
Common Name English
1,2-ETHANEDIAMINE, N1,N1-DIETHYL-N2-(2-NITROPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
40516-95-8
Created by admin on Tue Apr 01 19:59:49 GMT 2025 , Edited by admin on Tue Apr 01 19:59:49 GMT 2025
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PUBCHEM
38507
Created by admin on Tue Apr 01 19:59:49 GMT 2025 , Edited by admin on Tue Apr 01 19:59:49 GMT 2025
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EPA CompTox
DTXSID60193528
Created by admin on Tue Apr 01 19:59:49 GMT 2025 , Edited by admin on Tue Apr 01 19:59:49 GMT 2025
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NSC
135988
Created by admin on Tue Apr 01 19:59:49 GMT 2025 , Edited by admin on Tue Apr 01 19:59:49 GMT 2025
PRIMARY
FDA UNII
52UHH5Z5EM
Created by admin on Tue Apr 01 19:59:49 GMT 2025 , Edited by admin on Tue Apr 01 19:59:49 GMT 2025
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