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Details

Stereochemistry ACHIRAL
Molecular Formula C13H22N4O2
Molecular Weight 266.3394
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(3-Aminopropyl)-N-methyl-N'-(2-nitrophenyl)propane-1,3-diamine

SMILES

CN(CCCN)CCCNC1=CC=CC=C1[N+]([O-])=O

InChI

InChIKey=WRRAOGAZOQEGQE-UHFFFAOYSA-N
InChI=1S/C13H22N4O2/c1-16(10-4-8-14)11-5-9-15-12-6-2-3-7-13(12)17(18)19/h2-3,6-7,15H,4-5,8-11,14H2,1H3

HIDE SMILES / InChI

Molecular Formula C13H22N4O2
Molecular Weight 266.3394
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 Sat Dec 16 12:29:50 GMT 2023
Edited
by admin
on Sat Dec 16 12:29:50 GMT 2023
Record UNII
MMN2SVD579
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(3-Aminopropyl)-N-methyl-N'-(2-nitrophenyl)propane-1,3-diamine
Systematic Name English
N1-(3-Aminopropyl)-N1-methyl-N3-(2-nitrophenyl)-1,3-propanediamine
Systematic Name English
1,3-Propanediamine, N1-(3-aminopropyl)-N1-methyl-N3-(2-nitrophenyl)-
Systematic Name English
1,3-Propanediamine, N-(3-aminopropyl)-N-methyl-N′-(2-nitrophenyl)-
Systematic Name English
Code System Code Type Description
FDA UNII
MMN2SVD579
Created by admin on Sat Dec 16 12:29:50 GMT 2023 , Edited by admin on Sat Dec 16 12:29:50 GMT 2023
PRIMARY
CAS
68039-17-8
Created by admin on Sat Dec 16 12:29:50 GMT 2023 , Edited by admin on Sat Dec 16 12:29:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID4071009
Created by admin on Sat Dec 16 12:29:50 GMT 2023 , Edited by admin on Sat Dec 16 12:29:50 GMT 2023
PRIMARY
PUBCHEM
106432
Created by admin on Sat Dec 16 12:29:50 GMT 2023 , Edited by admin on Sat Dec 16 12:29:50 GMT 2023
PRIMARY
ECHA (EC/EINECS)
268-235-3
Created by admin on Sat Dec 16 12:29:50 GMT 2023 , Edited by admin on Sat Dec 16 12:29:50 GMT 2023
PRIMARY