Home Nitriles 3-Bromo-4-(ethylamino)-5-nitrobenzonitrile

3-Bromo-4-(ethylamino)-5-nitrobenzonitrile

CAS No.:
1420800-37-8
Catalog Number:
AG009X34
Molecular Formula:
C9H8BrN3O2
Molecular Weight:
270.0827
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG009X34
Chemical Name:
3-Bromo-4-(ethylamino)-5-nitrobenzonitrile
CAS Number:
1420800-37-8
Molecular Formula:
C9H8BrN3O2
Molecular Weight:
270.0827
MDL Number:
MFCD22689134
IUPAC Name:
3-bromo-4-(ethylamino)-5-nitrobenzonitrile
InChI:
InChI=1S/C9H8BrN3O2/c1-2-12-9-7(10)3-6(5-11)4-8(9)13(14)15/h3-4,12H,2H2,1H3
InChI Key:
QDOQBNSEYVUOSV-UHFFFAOYSA-N
SMILES:
CCNc1c(Br)cc(cc1[N+](=O)[O-])C#N
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.98g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.086g/mol
Monoisotopic Mass:
268.98g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties