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1357353-06-0

1357353-06-0 | 2-Benzyl-2-azaspiro[4.4]nonane-6-carbonitrile

CAS No: 1357353-06-0 Catalog No: AG00HUD0 MDL No:MFCD22209397

Product Description

Catalog Number:
AG00HUD0
Chemical Name:
2-Benzyl-2-azaspiro[4.4]nonane-6-carbonitrile
CAS Number:
1357353-06-0
Molecular Formula:
C16H20N2
Molecular Weight:
240.3434
MDL Number:
MFCD22209397
IUPAC Name:
2-benzyl-2-azaspiro[4.4]nonane-9-carbonitrile
InChI:
InChI=1S/C16H20N2/c17-11-15-7-4-8-16(15)9-10-18(13-16)12-14-5-2-1-3-6-14/h1-3,5-6,15H,4,7-10,12-13H2
InChI Key:
AZJDDEMTCSSXFD-UHFFFAOYSA-N
SMILES:
N#CC1CCCC21CCN(C2)Cc1ccccc1

Properties

Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.163g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.35g/mol
Monoisotopic Mass:
240.163g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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