Home Nitriles 4-Bromo-2-phenoxybenzonitrile

4-Bromo-2-phenoxybenzonitrile

CAS No.:
875664-25-8
Catalog Number:
AG00IEOT
Molecular Formula:
C13H8BrNO
Molecular Weight:
274.1127
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$149
- +
1g
95%
1 week
United States
$260
- +
Product Description
Catalog Number:
AG00IEOT
Chemical Name:
4-Bromo-2-phenoxybenzonitrile
CAS Number:
875664-25-8
Molecular Formula:
C13H8BrNO
Molecular Weight:
274.1127
MDL Number:
MFCD13193389
IUPAC Name:
4-bromo-2-phenoxybenzonitrile
InChI:
InChI=1S/C13H8BrNO/c14-11-7-6-10(9-15)13(8-11)16-12-4-2-1-3-5-12/h1-8H
InChI Key:
WFMNRTXOZNBDSV-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Oc1ccccc1)Br
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.979g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.117g/mol
Monoisotopic Mass:
272.979g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties