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Home > Other Heterocycles > 94584-69-7
94584-69-7 | Spiro[2.3]hexane-1,1,2,2-tetracarbonitrile
CAS No: 94584-69-7 Catalog No: AG00H5ZV MDL No:
Product Description
Catalog Number:
AG00H5ZV
Chemical Name:
Spiro[2.3]hexane-1,1,2,2-tetracarbonitrile
CAS Number:
94584-69-7
Molecular Formula:
C10H6N4
Molecular Weight:
182.1814
IUPAC Name:
spiro[2.3]hexane-1,1,2,2-tetracarbonitrile
InChI:
InChI=1S/C10H6N4/c11-4-9(5-12)8(2-1-3-8)10(9,6-13)7-14/h1-3H2
InChI Key:
JPAVHVSLQZXLDG-UHFFFAOYSA-N
SMILES:
N#CC1(C#N)C(C21CCC2)(C#N)C#N
NSC Number:
98317
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.186g/mol
Monoisotopic Mass:
182.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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