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Home > Other Heterocycles > 79421-39-9
79421-39-9 | 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)benzonitrile
CAS No: 79421-39-9 Catalog No: AG00GHBZ MDL No:
Product Description
Catalog Number:
AG00GHBZ
Chemical Name:
4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)benzonitrile
CAS Number:
79421-39-9
IUPAC Name:
4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)benzonitrile
InChI:
InChI=1S/C14H16N2O2/c15-11-12-1-3-13(4-2-12)16-7-5-14(6-8-16)17-9-10-18-14/h1-4H,5-10H2
InChI Key:
FGMYNGSWRAOYSV-UHFFFAOYSA-N
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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