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Home > Other Heterocycles > 958812-40-3
958812-40-3 | 8-Aza-bicyclo[3.2.1]octan-2-one
CAS No: 958812-40-3 Catalog No: AG00JQQW MDL No:MFCD23105907
Product Description
Catalog Number:
AG00JQQW
Chemical Name:
8-Aza-bicyclo[3.2.1]octan-2-one
CAS Number:
958812-40-3
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
MDL Number:
MFCD23105907
IUPAC Name:
8-azabicyclo[3.2.1]octan-2-one
InChI:
InChI=1S/C7H11NO/c9-7-4-2-5-1-3-6(7)8-5/h5-6,8H,1-4H2
InChI Key:
YCJKSIIIDRILDS-UHFFFAOYSA-N
SMILES:
O=C1CCC2NC1CC2
NSC Number:
359384
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.171g/mol
Monoisotopic Mass:
125.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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