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Retrosynthesis · AI + evidence

Diethylenetriamine (C4H13N3)

Diethylenetriamine (C4H13N3; CAS 111-40-0) is a practical retrosynthesis target. Diethylenetriamine presents a C4 framework, basic nitrogen. Open AI route search in one click below.

Target
Diethylenetriamine
CAS
111-40-0
Formula
C4H13N3
Approx. MW
103.17
SMILES
NCCNCCN
PubChem CID
8111
Approx. carbons
C4

Diethylenetriamine structure

Properties

IUPAC name
N'-(2-aminoethyl)ethane-1,2-diamine
Common names
DIETHYLENETRIAMINE; 111-40-0; Bis(2-aminoethyl)amine; 2,2'-Diaminodiethylamine; 1,4,7-Triazaheptane; DETA; Diethylene triamine; Barsamide 115; Epicure T; Ancamine DETA
Molecular weight
103.17
Exact mass
103.11
InChIKey
RPNUMPOLZDHAAY-UHFFFAOYSA-N
Melting point
-38 °F (NTP, 1992)
Boiling point
405 °F at 760 mmHg (NTP, 1992)
Density
0.954 at 68 °F (USCG, 1999) - Less dense than water; will float

View on PubChem

Diethylenetriamine 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Diethylenetriamine?

Diethylenetriamine has molecular formula C4H13N3. Molecular weight about 103.17 g·mol⁻¹.

What is the CAS number of Diethylenetriamine?

The CAS Registry Number for Diethylenetriamine is 111-40-0.

Run AI retrosynthesis for Diethylenetriamine Target catalog AI tools overview

Open the planner with Diethylenetriamine preloaded, then keep routes that match CAS 111-40-0.

Related targets

Similar compounds

(2-Chloroethyl)dimethylamine(2-methoxyethyl)(methyl)amine(3-Aminopropyl)methylamine2-(2-aminoethoxy)ethanamine2-Ethoxyethylamine3-Methoxypropionitrile

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References & tools