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Home > Other Heterocycles > 2031259-24-0
2031259-24-0 | 8-cyclopropyl-3-oxa-8-azabicyclo[3.2.1]octane-2,4-dione
CAS No: 2031259-24-0 Catalog No: AG01B5NU MDL No:MFCD30344738
Product Description
Catalog Number:
AG01B5NU
Chemical Name:
8-cyclopropyl-3-oxa-8-azabicyclo[3.2.1]octane-2,4-dione
CAS Number:
2031259-24-0
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD30344738
IUPAC Name:
8-cyclopropyl-3-oxa-8-azabicyclo[3.2.1]octane-2,4-dione
InChI:
InChI=1S/C9H11NO3/c11-8-6-3-4-7(9(12)13-8)10(6)5-1-2-5/h5-7H,1-4H2
InChI Key:
LWQAQDPQCLVMFL-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2N(C1CC2)C1CC1
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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