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Home > Other Heterocycles > 1210949-40-8
1210949-40-8 | 9-cyclopropyl-3,9-diazabicyclo[4.2.1]nonan-4-one
CAS No: 1210949-40-8 Catalog No: AG019R5U MDL No:MFCD13196456
Product Description
Catalog Number:
AG019R5U
Chemical Name:
9-cyclopropyl-3,9-diazabicyclo[4.2.1]nonan-4-one
CAS Number:
1210949-40-8
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
MDL Number:
MFCD13196456
IUPAC Name:
9-cyclopropyl-3,9-diazabicyclo[4.2.1]nonan-4-one
InChI:
InChI=1S/C10H16N2O/c13-10-5-8-3-4-9(6-11-10)12(8)7-1-2-7/h7-9H,1-6H2,(H,11,13)
InChI Key:
RFRSNTYIFVBMJA-UHFFFAOYSA-N
SMILES:
O=C1NCC2N(C(C1)CC2)C1CC1
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:
0.5
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