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Home > Other Heterocycles > 1087798-48-8
1087798-48-8 | 3-propyl-3-azabicyclo[3.2.1]octan-8-one
CAS No: 1087798-48-8 Catalog No: AG019QXN MDL No:MFCD13806427
Product Description
Catalog Number:
AG019QXN
Chemical Name:
3-propyl-3-azabicyclo[3.2.1]octan-8-one
CAS Number:
1087798-48-8
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
MDL Number:
MFCD13806427
IUPAC Name:
3-propyl-3-azabicyclo[3.2.1]octan-8-one
InChI:
InChI=1S/C10H17NO/c1-2-5-11-6-8-3-4-9(7-11)10(8)12/h8-9H,2-7H2,1H3
InChI Key:
OWVPKAYXJLCICH-UHFFFAOYSA-N
SMILES:
CCCN1CC2CCC(C1)C2=O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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