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Home > Other Heterocycles > 7489-52-3
7489-52-3 | 9-azabicyclo[6.2.0]decane
CAS No: 7489-52-3 Catalog No: AG01A02I MDL No:MFCD21758456
Product Description
Catalog Number:
AG01A02I
Chemical Name:
9-azabicyclo[6.2.0]decane
CAS Number:
7489-52-3
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD21758456
IUPAC Name:
9-azabicyclo[6.2.0]decane
InChI:
InChI=1S/C9H17N/c1-2-4-6-9-8(5-3-1)7-10-9/h8-10H,1-7H2
InChI Key:
LWKCFWMJXFWVDW-UHFFFAOYSA-N
SMILES:
C1CCCC2C(CC1)NC2
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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