Azacyclotridecan-2-one


Chemical Name: Azacyclotridecan-2-one
CAS Number: 947-04-6
Product Number: AG003THD(AGN-PC-0JKBBJ)
Synonyms:
MDL No:
Molecular Formula: C12H23NO
Molecular Weight: 197.3171

Identification/Properties


Properties
MP:
150-153 °C(lit.)
BP:
334.44°C (rough estimate)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4400 (estimate)
Computed Properties
Molecular Weight:
197.322g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
197.178g/mol
Monoisotopic Mass:
197.178g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
156
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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