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Home > Other Heterocycles > 1823925-04-7

1823925-04-7

1823925-04-7 | 4-(Bicyclo[1.1.1]pentan-1-yl)benzonitrile

CAS No: 1823925-04-7 Catalog No: AG01FHB9 MDL No:

Product Description

Catalog Number:
AG01FHB9
Chemical Name:
4-(Bicyclo[1.1.1]pentan-1-yl)benzonitrile
CAS Number:
1823925-04-7
IUPAC Name:
4-(1-bicyclo[1.1.1]pentanyl)benzonitrile
InChI:
InChI=1S/C12H11N/c13-8-9-1-3-11(4-2-9)12-5-10(6-12)7-12/h1-4,10H,5-7H2
InChI Key:
RWCHTKQYPQXLLL-UHFFFAOYSA-N

Properties

Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.089g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.227g/mol
Monoisotopic Mass:
169.089g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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