1H-1,4-Diazepine, hexahydro-1-(phenylmethyl)-


Chemical Name: 1H-1,4-Diazepine, hexahydro-1-(phenylmethyl)-
CAS Number: 4410-12-2
Product Number: AG003289(AGN-PC-0JO7E1)
Synonyms:
MDL No:
Molecular Formula: C12H18N2
Molecular Weight: 190.2847

Identification/Properties


Properties
BP:
286.5±28.0°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Stability:
Air Sensitive
Refractive Index:
n20/D 1.547
Computed Properties
Molecular Weight:
190.29g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
190.147g/mol
Monoisotopic Mass:
190.147g/mol
Topological Polar Surface Area:
15.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
152
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


NMR Spectrum


Other Analytical Data


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