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Home > Other Heterocycles > 956938-47-9
956938-47-9 | 3-Isopropyl-1,5-dimethyl-3,7-diaza-bicyclo[3.3.1]nonan-9-ol
CAS No: 956938-47-9 Catalog No: AG01F06M MDL No:
Product Description
Catalog Number:
AG01F06M
Chemical Name:
3-Isopropyl-1,5-dimethyl-3,7-diaza-bicyclo[3.3.1]nonan-9-ol
CAS Number:
956938-47-9
Molecular Formula:
C12H24N2O
Molecular Weight:
212.3318
IUPAC Name:
1,5-dimethyl-3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonan-9-ol
InChI:
InChI=1S/C12H24N2O/c1-9(2)14-7-11(3)5-13-6-12(4,8-14)10(11)15/h9-10,13,15H,5-8H2,1-4H3
InChI Key:
SRWIIWJAYHBKFC-UHFFFAOYSA-N
SMILES:
CC(N1CC2(C)CNCC(C1)(C2O)C)C
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.189g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.337g/mol
Monoisotopic Mass:
212.189g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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