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1268520-07-5 | (1S,6R)-Rel-8-Acetyl-3,8-diazabicyclo[4.2.0]octane
CAS No: 1268520-07-5 Catalog No: AG00HRLA MDL No:
Product Description
Catalog Number:
AG00HRLA
Chemical Name:
(1S,6R)-Rel-8-Acetyl-3,8-diazabicyclo[4.2.0]octane
CAS Number:
1268520-07-5
IUPAC Name:
1-[(1S,6R)-3,8-diazabicyclo[4.2.0]octan-8-yl]ethanone
InChI:
InChI=1S/C8H14N2O/c1-6(11)10-5-7-2-3-9-4-8(7)10/h7-9H,2-5H2,1H3/t7-,8-/m1/s1
InChI Key:
NSZFCGYEVWVLOI-HTQZYQBOSA-N
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
154.111g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.213g/mol
Monoisotopic Mass:
154.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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