Home Nitriles 4-Amino-3-Bromo-5-methylbenzonitrile

4-Amino-3-Bromo-5-methylbenzonitrile

CAS No.:
99799-46-9
Catalog Number:
AG01F09C
Molecular Formula:
C8H7BrN2
Molecular Weight:
211.0586
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$146
- +
1g
98%
1 week
United States
$253
- +
5g
98%
1 week
United States
$885
- +
25g
98%
1 week
United States
$2732
- +
100g
98%
1 week
United States
$6975
- +
Product Description
Catalog Number:
AG01F09C
Chemical Name:
4-Amino-3-Bromo-5-methylbenzonitrile
CAS Number:
99799-46-9
Molecular Formula:
C8H7BrN2
Molecular Weight:
211.0586
MDL Number:
MFCD09800839
IUPAC Name:
4-amino-3-bromo-5-methylbenzonitrile
InChI:
InChI=1S/C8H7BrN2/c1-5-2-6(4-10)3-7(9)8(5)11/h2-3H,11H2,1H3
InChI Key:
XSTLURJCYVPCNE-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C)c(c(c1)Br)N
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.979g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.062g/mol
Monoisotopic Mass:
209.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties