Home Nitriles 4-Bromo-2,2-diphenylbutyronitrile

4-Bromo-2,2-diphenylbutyronitrile

CAS No.:
39186-58-8
Catalog Number:
AG0033X4
Molecular Formula:
C16H14BrN
Molecular Weight:
300.1931
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$39
- +
5g
98%
In Stock USA
United States
$48
- +
25g
98%
In Stock USA
United States
$66
- +
100g
98%
In Stock USA
United States
$112
- +
500g
98%
In Stock USA
United States
$428
- +
Product Description
Catalog Number:
AG0033X4
Chemical Name:
4-Bromo-2,2-diphenylbutyronitrile
CAS Number:
39186-58-8
Molecular Formula:
C16H14BrN
Molecular Weight:
300.1931
MDL Number:
MFCD00001845
IUPAC Name:
4-bromo-2,2-diphenylbutanenitrile
InChI:
InChI=1S/C16H14BrN/c17-12-11-16(13-18,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10H,11-12H2
InChI Key:
IGYSFJHVFHNOEI-UHFFFAOYSA-N
SMILES:
BrCCC(c1ccccc1)(c1ccccc1)C#N
EC Number:
254-337-5
NSC Number:
80688
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.031g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.199g/mol
Monoisotopic Mass:
299.031g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties