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Home > Other Heterocycles > 1865196-56-0
1865196-56-0 | 3-(furan-2-yl)-2-azaspiro[3.4]octan-1-one
CAS No: 1865196-56-0 Catalog No: AG01C6G5 MDL No:MFCD29991506
Product Description
Catalog Number:
AG01C6G5
Chemical Name:
3-(furan-2-yl)-2-azaspiro[3.4]octan-1-one
CAS Number:
1865196-56-0
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD29991506
IUPAC Name:
1-(furan-2-yl)-2-azaspiro[3.4]octan-3-one
InChI:
InChI=1S/C11H13NO2/c13-10-11(5-1-2-6-11)9(12-10)8-4-3-7-14-8/h3-4,7,9H,1-2,5-6H2,(H,12,13)
InChI Key:
JMYLZIQKVILZRB-UHFFFAOYSA-N
SMILES:
O=C1NC(C21CCCC2)c1ccco1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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