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PMDETA

CAS: 3030-47-5 | C9H23N3

2D Structure

3D Structure

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Basic Information

CAS Registry Number: 3030-47-5
Molecular Formula: C9H23N3
Molecular Weight: 173.304 g/mol

Names and Synonyms:

PMDETA
Pmdta
1,2-Ethanediamine, N1-[2-(dimethylamino)ethyl]-N1,N2,N2-trimethyl-
Diethylenetriamine, 1,1,4,7,7-pentamethyl-
1,2-Ethanediamine, N-[2-(dimethylamino)ethyl]-N,N′,N′-trimethyl-
N1-[2-(Dimethylamino)ethyl]-N1,N2,N2-trimethyl-1,2-ethanediamine
Pentamethyldiethylenetriamine
N,N,N′,N′′,N′′-Pentamethyldiethylenetriamine
PMDT
1,1,4,7,7-Pentamethyldiethylenetriamine
N,N,N′,N′,N′′-Pentamethylbis(2-aminoethyl)amine
PMDTA
Bis[2-(dimethylamino)ethyl]methylamine
N,N-Bis[2-(dimethylamino)ethyl]methylamine
2,5,8-Trimethyl-2,5,8-triazanonane
Toyocat DT
Polycat 5
N,N,N′,N′′,N′′-Pentamethyl-3-azapentane-1,5-diamine
Kaolizer 3
1,1,4,7,7-Pentamethyl-1,4,7-triazaheptane
PC CAT PMDETA
Desmorapid PV
N,N,N′,N′′,N′′-Pentamethyldiethylenetriamine
N,N,N′,N′′,N′′-Pentamethylbis(2-aminoethyl)amine
N-[2-(Dimethylamino)ethyl]-N,N′,N′-trimethyl-1,2-ethanediamine
Dabco PMDETA
NSC 65659
N-Methyl-N,N-bis(2-dimethylaminoethyl)amine
PC 5
Lupragen N 301
N 301
Jeffcat PMDETA
Niax C 5
Kao 3
N,N-Bis(2-dimethylaminoethyl)methanamine
Niax Catalyst C 5
Tegoamin PMDETA
KL 3
DY 5
AM 1
(2-[[2-(Dimethylamino)ethyl](methyl)amino]ethyl)dimethylamine
N1,N1,N3,N5,N5-Pentamethyl-3-azapentane-1,5-diamine

Identifiers:

SMILES:
CN(C)CCN(C)CCN(C)C
InChI:
InChI=1S/C9H23N3/c1-10(2)6-8-12(5)9-7-11(3)4/h6-9H2,1-5H3

Spectral Data

NMR, IR, and Mass spectral data

1H NMR
13C NMR
Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment
200 ppm 180 160 140 120 100 80 60 40 20 0 ppm
Shift (ppm) DEPT Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

All Properties

Comprehensive physical and chemical properties

Physical Properties

Property Value Source
molecular_mass 173.30 g/mol Legacy Database
wikipedia_url https://en.wikipedia.org/wiki/PMDTA None Legacy Database
cas-boiling-point 85-86 °C @ Press: 12 Torr None Legacy Database
cas-canonical-smile N(C)(C)CCN(C)CCN(C)C None Legacy Database
cas-inchi InChI=1S/C9H23N3/c1-10(2)6-8-12(5)9-7-11(3)4/h6-9H2,1-5H3 None Legacy Database
cas-inchi-key InChIKey=UKODFQOELJFMII-UHFFFAOYSA-N None Legacy Database
cas-melting-point 162-163 °C None Legacy Database
cas-name Pentamethyldiethylenetriamine None Legacy Database
wikipedia-name PMDTA None Legacy Database
LogP 0.04140000000000099 RDKit

Molecular

Property Value Source
Molecular Weight 173.304 g/mol RDKit

Exact

Property Value Source
Exact Molecular Weight 173.18919773599998 g/mol RDKit

Heavy

Property Value Source
Heavy Atom Count 12 count RDKit

Hydrogen

Property Value Source
Hydrogen Bond Acceptors 3 count RDKit
Hydrogen Bond Donors 0 count RDKit

Rotatable

Property Value Source
Rotatable Bonds 6 count RDKit

Aromatic

Property Value Source
Aromatic Ring Count 0 count RDKit

Topological

Property Value Source
Topological Polar Surface Area 9.72 Ų RDKit

Molar

Property Value Source
Molar Refractivity 54.60500000000005 RDKit

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