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Home > Other Heterocycles > 2059945-06-9
2059945-06-9 | 6-oxaspiro[4.6]undec-8-ene-2-carbonitrile
CAS No: 2059945-06-9 Catalog No: AG01BZNW MDL No:MFCD30488760
Product Description
Catalog Number:
AG01BZNW
Chemical Name:
6-oxaspiro[4.6]undec-8-ene-2-carbonitrile
CAS Number:
2059945-06-9
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD30488760
IUPAC Name:
6-oxaspiro[4.6]undec-8-ene-3-carbonitrile
InChI:
InChI=1S/C11H15NO/c12-9-10-4-6-11(8-10)5-2-1-3-7-13-11/h1,3,10H,2,4-8H2
InChI Key:
DBEMGELXUXOGOG-UHFFFAOYSA-N
SMILES:
N#CC1CCC2(C1)CCC=CCO2
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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