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Home > Other Heterocycles > 88885-92-1
88885-92-1 | 1,7-Diazabicyclo[5.5.4]hexadecane(9CI)
CAS No: 88885-92-1 Catalog No: AG00497K MDL No:
Product Description
Catalog Number:
AG00497K
Chemical Name:
1,7-Diazabicyclo[5.5.4]hexadecane(9CI)
CAS Number:
88885-92-1
Molecular Formula:
C14H28N2
Molecular Weight:
224.3855
IUPAC Name:
1,7-diazabicyclo[5.5.4]hexadecane
InChI:
InChI=1S/C14H28N2/c1-3-9-15-11-5-2-6-12-16(10-4-1)14-8-7-13-15/h1-14H2
InChI Key:
XQMAPEXROAZAMN-UHFFFAOYSA-N
SMILES:
C1CCN2CCCCN(CC1)CCCCC2
Properties
Complexity:
150
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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