Home Other Building Blocks 4-Bromo-3-cyanoindole

4-Bromo-3-cyanoindole

CAS No.:
903131-13-5
Catalog Number:
AG006FP5
Molecular Formula:
C9H5BrN2
Molecular Weight:
221.0534
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$142
- +
1g
1 week
United States
$206
- +
5g
95%
1 week
United States
$663
- +
Product Description
Catalog Number:
AG006FP5
Chemical Name:
4-Bromo-3-cyanoindole
CAS Number:
903131-13-5
Molecular Formula:
C9H5BrN2
Molecular Weight:
221.0534
MDL Number:
MFCD07787361
IUPAC Name:
4-bromo-1H-indole-3-carbonitrile
InChI:
InChI=1S/C9H5BrN2/c10-7-2-1-3-8-9(7)6(4-11)5-12-8/h1-3,5,12H
InChI Key:
PMIGAISGWPTELT-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]c2c1c(Br)ccc2
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.964g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.057g/mol
Monoisotopic Mass:
219.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties