Home Halogens 2-(4-bromo-2-chlorophenoxy)propanenitrile

2-(4-bromo-2-chlorophenoxy)propanenitrile

CAS No.:
951920-69-7
Catalog Number:
AG01DWWN
Molecular Formula:
C9H7BrClNO
Molecular Weight:
260.5150
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DWWN
Chemical Name:
2-(4-bromo-2-chlorophenoxy)propanenitrile
CAS Number:
951920-69-7
Molecular Formula:
C9H7BrClNO
Molecular Weight:
260.5150
MDL Number:
MFCD09906551
IUPAC Name:
2-(4-bromo-2-chlorophenoxy)propanenitrile
InChI:
InChI=1S/C9H7BrClNO/c1-6(5-12)13-9-3-2-7(10)4-8(9)11/h2-4,6H,1H3
InChI Key:
GWKJRFPDTCDADM-UHFFFAOYSA-N
SMILES:
N#CC(Oc1ccc(cc1Cl)Br)C
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.94g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.515g/mol
Monoisotopic Mass:
258.94g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties