Home Nitriles 2-(4-Bromo-2-methylphenyl)acetonitrile

2-(4-Bromo-2-methylphenyl)acetonitrile

CAS No.:
215800-05-8
Catalog Number:
AG007PWM
Molecular Formula:
C9H8BrN
Molecular Weight:
210.0705
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$119
- +
5g
98%
In Stock USA
United States
$363
- +
10g
98%
In Stock USA
United States
$613
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG007PWM
Chemical Name:
2-(4-Bromo-2-methylphenyl)acetonitrile
CAS Number:
215800-05-8
Molecular Formula:
C9H8BrN
Molecular Weight:
210.0705
MDL Number:
MFCD14582920
IUPAC Name:
2-(4-bromo-2-methylphenyl)acetonitrile
InChI:
InChI=1S/C9H8BrN/c1-7-6-9(10)3-2-8(7)4-5-11/h2-3,6H,4H2,1H3
InChI Key:
JVPNKXZIJKBMDH-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(cc1C)Br
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.984g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.074g/mol
Monoisotopic Mass:
208.984g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties