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Home > Other Heterocycles > 910333-74-3
910333-74-3 | (1S,6R)-6-methyl-7-azabicyclo[4.2.0]octan-8-one
CAS No: 910333-74-3 Catalog No: AG00J0CN MDL No:MFCD28346226
Product Description
Catalog Number:
AG00J0CN
Chemical Name:
(1S,6R)-6-methyl-7-azabicyclo[4.2.0]octan-8-one
CAS Number:
910333-74-3
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
MDL Number:
MFCD28346226
IUPAC Name:
(1R,6R)-6-methyl-7-azabicyclo[4.2.0]octan-8-one
InChI:
InChI=1S/C8H13NO/c1-8-5-3-2-4-6(8)7(10)9-8/h6H,2-5H2,1H3,(H,9,10)/t6-,8+/m0/s1
InChI Key:
BZIGCUVLBNZWBP-POYBYMJQSA-N
SMILES:
O=C1N[C@]2([C@@H]1CCCC2)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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