Home Nitriles 2-(5-Bromo-2-methoxyphenoxy)acetonitrile

2-(5-Bromo-2-methoxyphenoxy)acetonitrile

CAS No.:
1221793-69-6
Catalog Number:
AG0016VU
Molecular Formula:
C9H8BrNO2
Molecular Weight:
242.0693
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG0016VU
Chemical Name:
2-(5-Bromo-2-methoxyphenoxy)acetonitrile
CAS Number:
1221793-69-6
Molecular Formula:
C9H8BrNO2
Molecular Weight:
242.0693
MDL Number:
MFCD16036123
IUPAC Name:
2-(5-bromo-2-methoxyphenoxy)acetonitrile
InChI:
InChI=1S/C9H8BrNO2/c1-12-8-3-2-7(10)6-9(8)13-5-4-11/h2-3,6H,5H2,1H3
InChI Key:
PQWGGDKJXBFASE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCC#N)Br
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.072g/mol
Monoisotopic Mass:
240.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties