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Home > Other Heterocycles > 1253790-21-4
1253790-21-4 | 4-Oxa-7-azaspiro[2.5]octan-6-one
CAS No: 1253790-21-4 Catalog No: AG000NKW MDL No:
Product Description
Catalog Number:
AG000NKW
Chemical Name:
4-Oxa-7-azaspiro[2.5]octan-6-one
CAS Number:
1253790-21-4
Molecular Formula:
C6H9NO2
Molecular Weight:
127.1412
IUPAC Name:
4-oxa-7-azaspiro[2.5]octan-6-one
InChI:
InChI=1S/C6H9NO2/c8-5-3-9-6(1-2-6)4-7-5/h1-4H2,(H,7,8)
InChI Key:
ZCAHJGUQWHVUJE-UHFFFAOYSA-N
SMILES:
O=C1COC2(CN1)CC2
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.063g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
127.143g/mol
Monoisotopic Mass:
127.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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