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Home > Other Heterocycles > 1272321-84-2
1272321-84-2 | 3,6-Diazabicyclo[3.2.1]octan-2-one, 6-cyclobutyl-
CAS No: 1272321-84-2 Catalog No: AG000WRY MDL No:
Product Description
Catalog Number:
AG000WRY
Chemical Name:
3,6-Diazabicyclo[3.2.1]octan-2-one, 6-cyclobutyl-
CAS Number:
1272321-84-2
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
IUPAC Name:
6-cyclobutyl-3,6-diazabicyclo[3.2.1]octan-2-one
InChI:
InChI=1S/C10H16N2O/c13-10-7-4-9(5-11-10)12(6-7)8-2-1-3-8/h7-9H,1-6H2,(H,11,13)
InChI Key:
DIFVRJUMAFQNJG-UHFFFAOYSA-N
SMILES:
O=C1NCC2CC1CN2C1CCC1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.251g/mol
Monoisotopic Mass:
180.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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