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Home > Other Heterocycles > 141632-78-2
141632-78-2 | Spiro[4.5]decane-6-carbonitrile
CAS No: 141632-78-2 Catalog No: AG001GPK MDL No:
Product Description
Catalog Number:
AG001GPK
Chemical Name:
Spiro[4.5]decane-6-carbonitrile
CAS Number:
141632-78-2
Molecular Formula:
C11H17N
Molecular Weight:
163.2594
IUPAC Name:
spiro[4.5]decane-10-carbonitrile
InChI:
InChI=1S/C11H17N/c12-9-10-5-1-2-6-11(10)7-3-4-8-11/h10H,1-8H2
InChI Key:
BKJWATAMLRBANP-UHFFFAOYSA-N
SMILES:
N#CC1CCCCC21CCCC2
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.136g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.264g/mol
Monoisotopic Mass:
163.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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