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Home > Other Heterocycles > 39974-68-0
39974-68-0 | 3,8-Dioxa-1-azaspiro[4.5]decane-2,4-dione
CAS No: 39974-68-0 Catalog No: AG00J7QP MDL No:MFCD24559854
Product Description
Catalog Number:
AG00J7QP
Chemical Name:
3,8-Dioxa-1-azaspiro[4.5]decane-2,4-dione
CAS Number:
39974-68-0
Molecular Formula:
C7H9NO4
Molecular Weight:
171.1507
MDL Number:
MFCD24559854
IUPAC Name:
3,8-dioxa-1-azaspiro[4.5]decane-2,4-dione
InChI:
InChI=1S/C7H9NO4/c9-5-7(8-6(10)12-5)1-3-11-4-2-7/h1-4H2,(H,8,10)
InChI Key:
DSFJJABYHBJIMB-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)NC21CCOCC2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.053g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.152g/mol
Monoisotopic Mass:
171.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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