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Home > Other Heterocycles > 1878415-56-5
1878415-56-5 | 6,6-dimethyl-1-oxaspiro[2.6]nonane-2-carbonitrile
CAS No: 1878415-56-5 Catalog No: AG01C6NL MDL No:MFCD31432168
Product Description
Catalog Number:
AG01C6NL
Chemical Name:
6,6-dimethyl-1-oxaspiro[2.6]nonane-2-carbonitrile
CAS Number:
1878415-56-5
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD31432168
IUPAC Name:
6,6-dimethyl-1-oxaspiro[2.6]nonane-2-carbonitrile
InChI:
InChI=1S/C11H17NO/c1-10(2)4-3-5-11(7-6-10)9(8-12)13-11/h9H,3-7H2,1-2H3
InChI Key:
GLRRKMPYKYQZML-UHFFFAOYSA-N
SMILES:
N#CC1OC21CCCC(CC2)(C)C
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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