Home Nitriles 4-(3-Oxocyclopentyl)benzonitrile

4-(3-Oxocyclopentyl)benzonitrile

CAS No.:
284022-94-2
Catalog Number:
AG00I5BY
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$410
- +
1g
95%
1 week
United States
$967
- +
Product Description
Catalog Number:
AG00I5BY
Chemical Name:
4-(3-Oxocyclopentyl)benzonitrile
CAS Number:
284022-94-2
MDL Number:
MFCD06659807
IUPAC Name:
4-(3-oxocyclopentyl)benzonitrile
InChI:
InChI=1S/C12H11NO/c13-8-9-1-3-10(4-2-9)11-5-6-12(14)7-11/h1-4,11H,5-7H2
InChI Key:
DAJJPEJONXVOKT-UHFFFAOYSA-N
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.226g/mol
Monoisotopic Mass:
185.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties