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29108-54-1

29108-54-1 | 1,2-Ethanediamine, N1,N1,N2-trimethyl-N2-(2-pyridinylmethyl)-

CAS No: 29108-54-1 Catalog No: AG002XCE MDL No:

Product Description

Catalog Number:
AG002XCE
Chemical Name:
1,2-Ethanediamine, N1,N1,N2-trimethyl-N2-(2-pyridinylmethyl)-
CAS Number:
29108-54-1
Molecular Formula:
C11H19N3
Molecular Weight:
193.2887
IUPAC Name:
N,N,N'-trimethyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
InChI:
InChI=1S/C11H19N3/c1-13(2)8-9-14(3)10-11-6-4-5-7-12-11/h4-7H,8-10H2,1-3H3
InChI Key:
POQDIYFIWFBBQQ-UHFFFAOYSA-N
SMILES:
CN(Cc1ccccn1)CCN(C)C

Properties

Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.158g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.294g/mol
Monoisotopic Mass:
193.158g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
19.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Literature

Title Journal
Synthesis, structure, spectra and reactivity of iron(III) complexes of facially coordinating and sterically hindering 3N ligands as models for catechol dioxygenases. Dalton transactions (Cambridge, England : 2003) 20081228

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