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Home > Other Heterocycles > 1820716-61-7
1820716-61-7 | 3-(propan-2-yl)-5-oxa-2-azaspiro[3.4]octan-1-one
CAS No: 1820716-61-7 Catalog No: AG01ALZV MDL No:MFCD29033865
Product Description
Catalog Number:
AG01ALZV
Chemical Name:
3-(propan-2-yl)-5-oxa-2-azaspiro[3.4]octan-1-one
CAS Number:
1820716-61-7
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
MDL Number:
MFCD29033865
IUPAC Name:
1-propan-2-yl-5-oxa-2-azaspiro[3.4]octan-3-one
InChI:
InChI=1S/C9H15NO2/c1-6(2)7-9(8(11)10-7)4-3-5-12-9/h6-7H,3-5H2,1-2H3,(H,10,11)
InChI Key:
KSAVLIIUTYGKLS-UHFFFAOYSA-N
SMILES:
CC(C1NC(=O)C21CCCO2)C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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