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898757-64-7

898757-64-7 | 4-CYANO-4'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]BENZOPHENONE

CAS No: 898757-64-7 Catalog No: AG00GWND MDL No:

Product Description

Catalog Number:
AG00GWND
Chemical Name:
4-CYANO-4'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]BENZOPHENONE
CAS Number:
898757-64-7
IUPAC Name:
4-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)benzoyl]benzonitrile
InChI:
InChI=1S/C22H22N2O3/c23-15-17-1-5-19(6-2-17)21(25)20-7-3-18(4-8-20)16-24-11-9-22(10-12-24)26-13-14-27-22/h1-8H,9-14,16H2
InChI Key:
HFTYBRGEPJPIET-UHFFFAOYSA-N

Properties

Complexity:
551  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.163g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.429g/mol
Monoisotopic Mass:
362.163g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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