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Home > Other Heterocycles > 1862696-95-4
1862696-95-4 | 5,5,7,7-tetramethyl-1-oxaspiro[2.5]octane-2-carbonitrile
CAS No: 1862696-95-4 Catalog No: AG01C6PI MDL No:MFCD31432251
Product Description
Catalog Number:
AG01C6PI
Chemical Name:
5,5,7,7-tetramethyl-1-oxaspiro[2.5]octane-2-carbonitrile
CAS Number:
1862696-95-4
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
MDL Number:
MFCD31432251
IUPAC Name:
5,5,7,7-tetramethyl-1-oxaspiro[2.5]octane-2-carbonitrile
InChI:
InChI=1S/C12H19NO/c1-10(2)6-11(3,4)8-12(7-10)9(5-13)14-12/h9H,6-8H2,1-4H3
InChI Key:
VIJHRHCAVIUJBC-UHFFFAOYSA-N
SMILES:
N#CC1OC21CC(C)(C)CC(C2)(C)C
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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