Home Nitriles 2-Bromo-3-methoxybenzonitrile

2-Bromo-3-methoxybenzonitrile

CAS No.:
1261816-95-8
Catalog Number:
AG000S10
Molecular Formula:
C8H6BrNO
Molecular Weight:
212.0433
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$150
- +
1g
97%
In Stock USA
United States
$407
- +
5g
97%
In Stock USA
United States
$1207
- +
Product Description
Catalog Number:
AG000S10
Chemical Name:
2-Bromo-3-methoxybenzonitrile
CAS Number:
1261816-95-8
Molecular Formula:
C8H6BrNO
Molecular Weight:
212.0433
MDL Number:
MFCD09834772
IUPAC Name:
2-bromo-3-methoxybenzonitrile
InChI:
InChI=1S/C8H6BrNO/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4H,1H3
InChI Key:
FQKUIMZTAJYITH-UHFFFAOYSA-N
SMILES:
COc1cccc(c1Br)C#N
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.963g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.046g/mol
Monoisotopic Mass:
210.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties