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Home > Other Heterocycles > 173973-33-6
173973-33-6 | (1s,5s)-3,7-bis(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
CAS No: 173973-33-6 Catalog No: AG00IZQL MDL No:MFCD09027159
Product Description
Catalog Number:
AG00IZQL
Chemical Name:
(1s,5s)-3,7-bis(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
CAS Number:
173973-33-6
Molecular Formula:
C13H24N2O
Molecular Weight:
224.3425
MDL Number:
MFCD09027159
IUPAC Name:
3,7-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
InChI:
InChI=1S/C13H24N2O/c1-9(2)14-5-11-7-15(10(3)4)8-12(6-14)13(11)16/h9-12H,5-8H2,1-4H3
InChI Key:
YGTKXITWJVCHQV-UHFFFAOYSA-N
SMILES:
CC(N1CC2CN(C[C@H](C1)C2=O)C(C)C)C
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.189g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.348g/mol
Monoisotopic Mass:
224.189g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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