Home Halogens N-Acetyl 2-bromo-4-chloroaniline

N-Acetyl 2-bromo-4-chloroaniline

CAS No.:
57045-85-9
Catalog Number:
AG00EBNH
Molecular Formula:
C8H7BrClNO
Molecular Weight:
248.5043
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG00EBNH
Chemical Name:
N-Acetyl 2-bromo-4-chloroaniline
CAS Number:
57045-85-9
Molecular Formula:
C8H7BrClNO
Molecular Weight:
248.5043
MDL Number:
MFCD00040851
IUPAC Name:
N-(2-bromo-4-chlorophenyl)acetamide
InChI:
InChI=1S/C8H7BrClNO/c1-5(12)11-8-3-2-6(10)4-7(8)9/h2-4H,1H3,(H,11,12)
InChI Key:
FXRJRUAYMSVQKU-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1Br)Cl
EC Number:
611-452-9
NSC Number:
136497
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.94g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.504g/mol
Monoisotopic Mass:
246.94g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties