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Home > Other Heterocycles > 671225-03-9
671225-03-9 | 4,6,11-TRIOXA-1-AZABICYCLO[3.3.3]UNDECANE
CAS No: 671225-03-9 Catalog No: AG006LG8 MDL No:
Product Description
Catalog Number:
AG006LG8
Chemical Name:
4,6,11-TRIOXA-1-AZABICYCLO[3.3.3]UNDECANE
CAS Number:
671225-03-9
Molecular Formula:
C7H13NO3
Molecular Weight:
159.1830
IUPAC Name:
4,6,11-trioxa-1-azabicyclo[3.3.3]undecane
InChI:
InChI=1S/C7H13NO3/c1-4-9-7-10-5-2-8(1)3-6-11-7/h7H,1-6H2
InChI Key:
POTHNOFJDJDBRS-UHFFFAOYSA-N
SMILES:
C1CN2CCOC(O1)OCC2
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.185g/mol
Monoisotopic Mass:
159.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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