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Home > Other Heterocycles > 2091583-60-5
2091583-60-5 | 1-oxa-8-azaspiro[4.5]decane-4-carbonitrile
CAS No: 2091583-60-5 Catalog No: AG01C9WL MDL No:MFCD31455366
Product Description
Catalog Number:
AG01C9WL
Chemical Name:
1-oxa-8-azaspiro[4.5]decane-4-carbonitrile
CAS Number:
2091583-60-5
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
MDL Number:
MFCD31455366
IUPAC Name:
1-oxa-8-azaspiro[4.5]decane-4-carbonitrile
InChI:
InChI=1S/C9H14N2O/c10-7-8-1-6-12-9(8)2-4-11-5-3-9/h8,11H,1-6H2
InChI Key:
HEFYFHHDEMSWCA-UHFFFAOYSA-N
SMILES:
N#CC1CCOC21CCNCC2
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.111g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.224g/mol
Monoisotopic Mass:
166.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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