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Home > Other Heterocycles > 1016835-29-2
1016835-29-2 | (2,4-dioxo-1,3-diazaspiro[4.4]non-3-yl)acetonitrile
CAS No: 1016835-29-2 Catalog No: AG0167E9 MDL No:
Product Description
Catalog Number:
AG0167E9
Chemical Name:
(2,4-dioxo-1,3-diazaspiro[4.4]non-3-yl)acetonitrile
CAS Number:
1016835-29-2
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
IUPAC Name:
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetonitrile
InChI:
InChI=1S/C9H11N3O2/c10-5-6-12-7(13)9(11-8(12)14)3-1-2-4-9/h1-4,6H2,(H,11,14)
InChI Key:
AEXKJQGPXXXFLY-UHFFFAOYSA-N
SMILES:
N#CCN1C(=O)NC2(C1=O)CCCC2
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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