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Home > Other Heterocycles > 258887-45-5
258887-45-5 | 6-HYDROXY-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-ONE
CAS No: 258887-45-5 Catalog No: AG01DKPC MDL No:
Product Description
Catalog Number:
AG01DKPC
Chemical Name:
6-HYDROXY-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-ONE
CAS Number:
258887-45-5
IUPAC Name:
6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-one
InChI:
InChI=1S/C8H13NO2/c1-9-5-2-6(10)4-7(9)8(11)3-5/h5,7-8,11H,2-4H2,1H3
InChI Key:
UOHSTKWPZWFYTF-UHFFFAOYSA-N
EC Number:
227-677-7
NSC Number:
102773
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.197g/mol
Monoisotopic Mass:
155.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Activity and QSAR study of baogongteng A and its derivatives as muscarinic agonists. | Bioorganic & medicinal chemistry letters 20051101 |
| Three-dimensional quantitative structure-activity relationship modeling of cocaine binding by a novel human monoclonal antibody. | Journal of medicinal chemistry 20040101 |
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