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Home > Other Heterocycles > 14651-45-7
14651-45-7 | Spiro[2.11]tetradecane-1,1,2,2-tetracarbonitrile
CAS No: 14651-45-7 Catalog No: AG001E3X MDL No:
Product Description
Catalog Number:
AG001E3X
Chemical Name:
Spiro[2.11]tetradecane-1,1,2,2-tetracarbonitrile
CAS Number:
14651-45-7
Molecular Formula:
C18H22N4
Molecular Weight:
294.3941
IUPAC Name:
spiro[2.11]tetradecane-1,1,2,2-tetracarbonitrile
InChI:
InChI=1S/C18H22N4/c19-12-17(13-20)16(18(17,14-21)15-22)10-8-6-4-2-1-3-5-7-9-11-16/h1-11H2
InChI Key:
IEQJSTHTZVZKHN-UHFFFAOYSA-N
SMILES:
N#CC1(C#N)C2(C1(C#N)C#N)CCCCCCCCCCC2
NSC Number:
98424
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.184g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.402g/mol
Monoisotopic Mass:
294.184g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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