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Home > Other Heterocycles > 110434-79-2
110434-79-2 | 1,3-Dioxa-4-azaspiro[5.5]undec-4-en-2-one, 5-(phenylmethoxy)-
CAS No: 110434-79-2 Catalog No: AG007D7U MDL No:
Product Description
Catalog Number:
AG007D7U
Chemical Name:
1,3-Dioxa-4-azaspiro[5.5]undec-4-en-2-one, 5-(phenylmethoxy)-
CAS Number:
110434-79-2
Molecular Formula:
C15H17NO4
Molecular Weight:
275.2998
IUPAC Name:
5-phenylmethoxy-1,3-dioxa-4-azaspiro[5.5]undec-4-en-2-one
InChI:
InChI=1S/C15H17NO4/c17-14-19-15(9-5-2-6-10-15)13(16-20-14)18-11-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2
InChI Key:
JCNGFPFEZBADLP-UHFFFAOYSA-N
SMILES:
O=C1ON=C(C2(O1)CCCCC2)OCc1ccccc1
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.304g/mol
Monoisotopic Mass:
275.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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