Home Nitriles 3-Bromo-5-nitro-4-(propylamino)benzonitrile

3-Bromo-5-nitro-4-(propylamino)benzonitrile

CAS No.:
1820686-50-7
Catalog Number:
AG00I0V2
Molecular Formula:
C10H10BrN3O2
Molecular Weight:
284.1093
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00I0V2
Chemical Name:
3-Bromo-5-nitro-4-(propylamino)benzonitrile
CAS Number:
1820686-50-7
Molecular Formula:
C10H10BrN3O2
Molecular Weight:
284.1093
MDL Number:
MFCD26383429
IUPAC Name:
3-bromo-5-nitro-4-(propylamino)benzonitrile
InChI:
InChI=1S/C10H10BrN3O2/c1-2-3-13-10-8(11)4-7(6-12)5-9(10)14(15)16/h4-5,13H,2-3H2,1H3
InChI Key:
WXQUNOVYGOXVIR-UHFFFAOYSA-N
SMILES:
CCCNc1c(Br)cc(cc1[N+](=O)[O-])C#N
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.996g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.113g/mol
Monoisotopic Mass:
282.996g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties