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


Chemical Name: 1H-1,4-Diazepine, hexahydro-1-(4-methoxyphenyl)-
CAS Number: 868063-60-9
Product Number: AG00IE7H(AGN-PC-00U0X0)
Synonyms:
MDL No: MFCD09909956
Molecular Formula: C12H18N2O
Molecular Weight: 206.2841

Identification/Properties


Computed Properties
Molecular Weight:
206.289g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
206.142g/mol
Monoisotopic Mass:
206.142g/mol
Topological Polar Surface Area:
24.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
179
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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