Home Nitriles 2-Bromo-6-isopropoxybenzonitrile

2-Bromo-6-isopropoxybenzonitrile

CAS No.:
1365272-13-4
Catalog Number:
AG009WXF
Molecular Formula:
C10H10BrNO
Molecular Weight:
240.0965
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$188
- +
5g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG009WXF
Chemical Name:
2-Bromo-6-isopropoxybenzonitrile
CAS Number:
1365272-13-4
Molecular Formula:
C10H10BrNO
Molecular Weight:
240.0965
MDL Number:
MFCD21609678
IUPAC Name:
2-bromo-6-propan-2-yloxybenzonitrile
InChI:
InChI=1S/C10H10BrNO/c1-7(2)13-10-5-3-4-9(11)8(10)6-12/h3-5,7H,1-2H3
InChI Key:
AKFSBPKXJDZPKA-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1C#N)Br)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.995g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.1g/mol
Monoisotopic Mass:
238.995g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties