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Home > Other Heterocycles > 163108-82-5
163108-82-5 | 4,10-Dioxa-1,7,15-triazabicyclo[5.5.5]heptadecane, 15-methyl-
CAS No: 163108-82-5 Catalog No: AG001TS6 MDL No:
Product Description
Catalog Number:
AG001TS6
Chemical Name:
4,10-Dioxa-1,7,15-triazabicyclo[5.5.5]heptadecane, 15-methyl-
CAS Number:
163108-82-5
Molecular Formula:
C13H27N3O2
Molecular Weight:
257.3724
IUPAC Name:
15-methyl-4,10-dioxa-1,7,15-triazabicyclo[5.5.5]heptadecane
InChI:
InChI=1S/C13H27N3O2/c1-14-2-4-15-6-10-17-12-8-16(5-3-14)9-13-18-11-7-15/h2-13H2,1H3
InChI Key:
HJFWIWLPPIKPPM-UHFFFAOYSA-N
SMILES:
CN1CCN2CCOCCN(CC1)CCOCC2
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.21g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.378g/mol
Monoisotopic Mass:
257.21g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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