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Home > Other Heterocycles > 77500-87-9
77500-87-9 | 7,9-Diazaspiro[4.5]decane-6,8,10-trione,7-phenyl-
CAS No: 77500-87-9 Catalog No: AG005HGB MDL No:
Product Description
Catalog Number:
AG005HGB
Chemical Name:
7,9-Diazaspiro[4.5]decane-6,8,10-trione,7-phenyl-
CAS Number:
77500-87-9
Molecular Formula:
C14H14N2O3
Molecular Weight:
258.2726
IUPAC Name:
9-phenyl-7,9-diazaspiro[4.5]decane-6,8,10-trione
InChI:
InChI=1S/C14H14N2O3/c17-11-14(8-4-5-9-14)12(18)16(13(19)15-11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,15,17,19)
InChI Key:
UDMFULAVIAWHCY-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C2(C(=O)N1c1ccccc1)CCCC2
NSC Number:
85140
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.277g/mol
Monoisotopic Mass:
258.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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