1,4,7,10-Tetraazacyclododecane


Chemical Name: 1,4,7,10-Tetraazacyclododecane
CAS Number: 294-90-6
Product Number: AG002Y9W(AGN-PC-0JL6IM)
Synonyms:
MDL No:
Molecular Formula: C8H20N4
Molecular Weight: 172.2712

Identification/Properties


Computed Properties
Molecular Weight:
172.276g/mol
XLogP3:
-2.4
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
172.169g/mol
Monoisotopic Mass:
172.169g/mol
Topological Polar Surface Area:
48.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
65.1
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H312-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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