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Home > Other Heterocycles > 39872-95-2
39872-95-2 | 8-azabicyclo[5.2.0]nonane
CAS No: 39872-95-2 Catalog No: AG019RKX MDL No:MFCD17977242
Product Description
Catalog Number:
AG019RKX
Chemical Name:
8-azabicyclo[5.2.0]nonane
CAS Number:
39872-95-2
Molecular Formula:
C8H15N
Molecular Weight:
125.2114
MDL Number:
MFCD17977242
IUPAC Name:
8-azabicyclo[5.2.0]nonane
InChI:
InChI=1S/C8H15N/c1-2-4-7-6-9-8(7)5-3-1/h7-9H,1-6H2
InChI Key:
JJVUJYHRYYMVMK-UHFFFAOYSA-N
SMILES:
C1CCC2C(CC1)CN2
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.12g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.215g/mol
Monoisotopic Mass:
125.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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