Home Other Heterocycles 102547-84-2
102547-84-2,MFCD13192515
Catalog No.:AA0007MA
102547-84-2 | 9-Methyl-3,9-diazabicyclo[4.2.1]nonane
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Technical Information
Catalog Number:
AA0007MA
Chemical Name:
9-Methyl-3,9-diazabicyclo[4.2.1]nonane
CAS Number:
102547-84-2
Molecular Formula:
C8H16N2
Molecular Weight:
140.2260
MDL Number:
MFCD13192515
IUPAC Name:
9-methyl-3,9-diazabicyclo[4.2.1]nonane
InChI:
InChI=1S/C8H16N2/c1-10-7-2-3-8(10)6-9-5-4-7/h7-9H,2-6H2,1H3
InChI Key:
NRCDIJJTFDJACX-UHFFFAOYSA-N
SMILES:
CN1C2CCNCC1CC2
Properties
Computed Properties
 
Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.131g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.23g/mol
Monoisotopic Mass:
140.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Synonyms
 
9-METHYL-3,9-DIAZABICYCLO[4.2.1]NONANE 
102547-84-2 
AB44656 
MCULE-2984561797 
NE25125 
(1S,6R)-9-methyl-3,9-diazabicyclo[4.2.1]nonane dihydrochloride 
AS-53655 
9-methyl-3,9-diazabicyclo[4.2.1 ]nonane 
9-Methyl-3,9-diazabicyclo-[4.2.1]-nonane 
13842-EP2301933A1 
13842-EP2311827A1 
13842-EP2316836A1 
3,9-Diazabicyclo[4.2.1]nonane,9-methyl- 
F2158-1000 
Z1281767073 
3,9-DIAZABICYCLO[4.2.1]NONANE, 9-METHYL- 
ACMC-20m5i7 
SCHEMBL929913 
CTK4A1184 
DTXSID40553545 
NRCDIJJTFDJACX-UHFFFAOYSA-N 
AKOS005141937 
Literature
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