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Home > Other Heterocycles > 84905-04-4
84905-04-4 | 1,8-DIAZABICYCLO[6.5.3]HEXADECANE
CAS No: 84905-04-4 Catalog No: AG004M05 MDL No:
Product Description
Catalog Number:
AG004M05
Chemical Name:
1,8-DIAZABICYCLO[6.5.3]HEXADECANE
CAS Number:
84905-04-4
Molecular Formula:
C14H28N2
Molecular Weight:
224.3855
IUPAC Name:
1,8-diazabicyclo[6.5.3]hexadecane
InChI:
InChI=1S/C14H28N2/c1-2-5-10-16-12-7-3-6-11-15(9-4-1)13-8-14-16/h1-14H2
InChI Key:
ICKDKENKQFLDMK-UHFFFAOYSA-N
SMILES:
C1CCCN2CCCN(CC1)CCCCC2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.225g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.392g/mol
Monoisotopic Mass:
224.225g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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