CAS 99892-23-6 | 1,4,7,10-Tetraazacyclododecane, 1,4,7-trimethyl- | CAS Number 99892-23-6

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99892-23-6 | 1,4,7,10-Tetraazacyclododecane, 1,4,7-trimethyl-

CAS No: 99892-23-6 Catalog No: AG003W0K MDL No:

Product Description

Catalog Number:

AG003W0K

Chemical Name:

1,4,7,10-Tetraazacyclododecane, 1,4,7-trimethyl-

CAS Number:

99892-23-6

Molecular Formula:

C11H26N4

Molecular Weight:

214.3509

IUPAC Name:

1,4,7-trimethyl-1,4,7,10-tetrazacyclododecane

InChI:

InChI=1S/C11H26N4/c1-13-6-4-12-5-7-14(2)9-11-15(3)10-8-13/h12H,4-11H2,1-3H3

InChI Key:

IIZJYENGWGJUSI-UHFFFAOYSA-N

SMILES:

CN1CCN(C)CCNCCN(CC1)C

Properties

Complexity:

147

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.216g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.357g/mol

Monoisotopic Mass:

214.216g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

21.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.8

Literature

Title	Journal
Rare-earth metal allyl and hydrido complexes supported by an (NNNN)-type macrocyclic ligand: synthesis, structure, and reactivity toward biomass-derived furanics.	Chemistry (Weinheim an der Bergstrasse, Germany) 20111223
Scandium alkyl and amide complexes containing a cyclen-derived (NNNN) macrocyclic ligand: synthesis, structure and ring-opening polymerization activity toward lactide monomers.	Dalton transactions (Cambridge, England : 2003) 20110814