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Home > Other Heterocycles > 1427173-49-6
1427173-49-6 | N-t-BOC-1,7-Diazaspiro[3.5]nonane p-Toluenesulfonate
CAS No: 1427173-49-6 Catalog No: AG01EGJM MDL No:
Product Description
Catalog Number:
AG01EGJM
Chemical Name:
N-t-BOC-1,7-Diazaspiro[3.5]nonane p-Toluenesulfonate
CAS Number:
1427173-49-6
IUPAC Name:
tert-butyl 1,7-diazaspiro[3.5]nonane-7-carboxylate;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C12H22N2O2.C7H8O3S/c1-11(2,3)16-10(15)14-8-5-12(6-9-14)4-7-13-12;1-6-2-4-7(5-3-6)11(8,9)10/h13H,4-9H2,1-3H3;2-5H,1H3,(H,8,9,10)
InChI Key:
PQOBUOIHPLNISH-UHFFFAOYSA-N
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
398.188g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
398.518g/mol
Monoisotopic Mass:
398.188g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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